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2023-11-16 06:57:59
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A9B3C2D
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Cs3 Na1 Cd2 F9
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2023-11-16 06:57:59
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c6f0b365e15537e0c8932c6e86020ec4_164_Cs3Na1Cd2F9
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A6B3C2D
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CdCs3La2S6
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Cs3 La2 Cd1 S6
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2023-11-16 06:57:59
|
[
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| 14.552055
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pbe
| true
|
0dea9edbe1e42289bb3bda608d845ac7_12_Cs3La2Cd1S6
|
[
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|
A2BCD
|
CdCuFO2
|
Cd1 Cu1 O2 F1
| 4
|
[
1,
1,
1
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[
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agm001741436
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[
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2023-11-16 06:57:59
|
[
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| 3.027226
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pbe
| true
|
9ea32454183421ce7b4aabfbd3c3546c_123_Cd1Cu1O2F1
|
[
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|
A2BCD
|
Cd2CuKPt
|
K1 Cd2 Cu1 Pt1
| 4
|
[
1,
1,
1
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[
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agm001636681
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[{"mass": null, "name": "Cd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cd"]}, {"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}, {"mass": null, "name": "Cu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cu"]}, {"mass": null, "name": "Pt", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pt"]}]
|
[
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2023-11-16 06:57:59
|
[
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[
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| 1.302832
|
pbe
| true
|
6796a7c488c2e5eba4014113c34b32c6_123_K1Cd2Cu1Pt1
|
[
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|
A2BCD
|
CdCuPb2Sc
|
Sc1 Cd1 Cu1 Pb2
| 4
|
[
1,
1,
1
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[
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agm001489640
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[{"mass": null, "name": "Cd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cd"]}, {"mass": null, "name": "Pb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pb"]}, {"mass": null, "name": "Cu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cu"]}, {"mass": null, "name": "Sc", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sc"]}]
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[
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2023-11-16 06:57:59
|
[
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0,
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|
pbe
| true
|
d8130972ea108a79075bc0f65371ba79_123_Sc1Cd1Cu1Pb2
|
[
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ABCD
|
CdCuPmPu
|
Pm1 Pu1 Cd1 Cu1
| 4
|
[
1,
1,
1
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[
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agm001914589
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|
[
"Cd",
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2023-11-16 06:57:59
|
[
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| 11.82583
|
pbe
| true
|
229abb726aefe34f07f90a920e24b225_216_Pm1Pu1Cd1Cu1
|
[
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|
ABCD
|
CdDyRuSc
|
Dy1 Sc1 Cd1 Ru1
| 4
|
[
1,
1,
1
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|
[
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3.37153979,
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[
0,
3.37153979,
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agm005193147
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|
[
"Dy",
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2023-11-16 06:57:59
|
[
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0.25
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[
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|
pbe
| true
|
d6d48e04c1c95e6e06d5ceb1aed00956_99_Dy1Sc1Cd1Ru1
|
[
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ABCD
|
CdErMnSc
|
Er1 Sc1 Mn1 Cd1
| 4
|
[
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1,
1
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[
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agm001328149
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|
[
"Sc",
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2023-11-16 06:57:59
|
[
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pbe
| true
|
64b81a10721a0d443730ca95129b6ca0_216_Er1Sc1Mn1Cd1
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A2BCD
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Cd2FNaZn
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Na1 Zn1 Cd2 F1
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agm001467369
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[
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2023-11-16 06:57:59
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[
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[
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pbe
| true
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ab138096398404a4bfa28f7c8bfee7c9_123_Na1Zn1Cd2F1
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A4B2CD
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Cd2GaHgPm4
|
Pm4 Cd2 Ga1 Hg1
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[
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agm004794600
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2023-11-16 06:57:59
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pbe
| true
|
f01f406662e8b41fddc947a4d2cb4212_166_Pm4Cd2Ga1Hg1
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[
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ABCD
|
CdGaMnPd
|
Mn1 Cd1 Ga1 Pd1
| 4
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[
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agm001325270
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2023-11-16 06:57:59
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pbe
| true
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d8e54362db703b9a82766fc68c273577_216_Mn1Cd1Ga1Pd1
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[
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A5B2C2D
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CdGa2Pt5Sm2
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Sm4 Cd2 Ga4 Pt10
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agm005131477
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2023-11-16 06:57:59
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pbe
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78165a4d42bedb307d049cd78842703f_127_Sm4Cd2Ga4Pt10
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ABCD
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CdGeMgPd
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agm001285443
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2023-11-16 06:57:59
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pbe
| true
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8841475ff2f61a2a39086e71e750fdc6_216_Mg1Cd1Ge1Pd1
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[
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A6B2C2D
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CdK2Np2Se6
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agm004583641
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2023-11-16 06:57:59
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[
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-0.00104196,
0.00233804
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[
-0.00074498,
-0.00079784,
0.00233804
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] | 5.999999
| 14.984208
|
pbe
| true
|
f7fdf1c8f2c33ce20a7facf1d6694d52_12_K2Np2Cd1Se6
|
[
"Cd",
"K",
"Rb",
"Se"
] | 5
|
A2BCD
|
CdKRb2Se
|
K1 Rb2 Cd1 Se1
| 4
|
[
1,
1,
1
] | 3
|
[
[
6.66893023,
0,
0
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[
0,
6.66893023,
0
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[
0,
0,
6.30502196
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agm001643766
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3.334465115,
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3.334465115,
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3.15251098
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|
[
"K",
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"Rb",
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] |
2023-11-16 06:57:59
|
[
0.2,
0.2,
0.4,
0.2
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[
[
0.745072,
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[
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0.745072,
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[
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[
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[
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[
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[
0,
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0
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[
0,
0,
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[
0,
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0
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| 3.413495
|
pbe
| true
|
69ea787a09b935deeced3ce511037189_123_K1Rb2Cd1Se1
|
[
"Cd",
"La",
"Pd",
"Sm"
] | 4
|
ABCD
|
CdLaPdSm
|
La1 Sm1 Cd1 Pd1
| 4
|
[
1,
1,
1
] | 3
|
[
[
5.31012459,
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0
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2.6550623,
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0
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2.6550623,
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agm001329020
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1.083924645
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[
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4.5987027975,
3.251773935
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[{"mass": null, "name": "Cd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cd"]}, {"mass": null, "name": "Sm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sm"]}, {"mass": null, "name": "Pd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pd"]}, {"mass": null, "name": "La", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["La"]}]
|
[
"Cd",
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"Sm",
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2023-11-16 06:57:59
|
[
0.25,
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0.25,
0.25
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[
[
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3.2980216,
0
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[
0,
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3.2980216
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[
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[
[
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[
0,
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0
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[
0,
0,
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[
0,
0,
0
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| 3.430682
|
pbe
| true
|
05d42dc63dbe6a5349637baebcab056b_216_La1Sm1Cd1Pd1
|
[
"Cd",
"Li",
"Pb",
"Y"
] | 4
|
ABCD
|
CdLiPbY
|
Li1 Y1 Cd1 Pb1
| 4
|
[
1,
1,
1
] | 3
|
[
[
5.17366938,
0,
0
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2.58683469,
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0
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[
2.58683469,
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4.22428336
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agm001315584
|
[
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4.4805291075,
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2.58683469,
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1.05607084
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[
0,
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0
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[{"mass": null, "name": "Cd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cd"]}, {"mass": null, "name": "Pb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pb"]}, {"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}]
|
[
"Pb",
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2023-11-16 06:57:59
|
[
0.25,
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0.25,
0.25
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[
[
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[
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[
0,
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0
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[
0,
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0
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[
0,
0,
0
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| 1.353703
|
pbe
| true
|
4be9eadca80d83efae697ef69daaeba2_216_Li1Y1Cd1Pb1
|
[
"Cd",
"Mg",
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"Pd"
] | 20
|
A5B2C2D
|
Cd2MgNd2Pd5
|
Nd4 Mg2 Cd4 Pd10
| 4
|
[
1,
1,
1
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|
[
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3.71152018,
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0
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0,
10.5177623,
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10.5177623
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agm005136926
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[{"mass": null, "name": "Cd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cd"]}, {"mass": null, "name": "Nd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nd"]}, {"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Pd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pd"]}]
|
[
"Nd",
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"Pd",
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"Pd",
"Pd",
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"Pd",
"Pd",
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2023-11-16 06:57:59
|
[
0.2,
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0.2,
0.5
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[
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[
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[
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[
0,
0,
0
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[
0,
0,
0
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| 12.040649
|
pbe
| true
|
8f2ee509d7e4e3caae029f965ef47792_127_Nd4Mg2Cd4Pd10
|
[
"Cd",
"Mg",
"Pr",
"Th"
] | 4
|
ABCD
|
CdMgPrTh
|
Pr1 Th1 Mg1 Cd1
| 4
|
[
1,
1,
1
] | 3
|
[
[
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0
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2.73183759,
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0
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2.73183759,
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4.46107211
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agm001329632
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[
0,
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0
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[
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3.3458040825
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[{"mass": null, "name": "Cd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cd"]}, {"mass": null, "name": "Th", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Th"]}, {"mass": null, "name": "Pr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pr"]}, {"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}]
|
[
"Pr",
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2023-11-16 06:57:59
|
[
0.25,
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0.25,
0.25
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[
[
1.5057757,
0,
0
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[
0,
1.5057757,
0
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[
0,
0,
1.5057757
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] | -14.994392
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[
0,
0,
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[
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0
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[
0,
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0
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[
0,
0,
0
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[
0,
0,
0
]
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| 4.852526
|
pbe
| true
|
a283304b59bc64ed13f40a1c31f410b6_216_Pr1Th1Mg1Cd1
|
[
"Cd",
"Na",
"O",
"Os"
] | 14
|
A8B3C2D
|
CdNa3O8Os2
|
Na3 Cd1 Os2 O8
| 4
|
[
1,
1,
1
] | 3
|
[
[
5.88519116,
0,
0
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[
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0
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[
0,
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agm004667743
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[
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2.163987712465879
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[
1.507566604691511,
0.8703939849225074,
5.1796166775341215
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[{"mass": null, "name": "Cd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cd"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "Na", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Na"]}, {"mass": null, "name": "Os", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Os"]}]
|
[
"Na",
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2023-11-16 06:57:59
|
[
0.07142857142857142,
0.21428571428571427,
0.5714285714285714,
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[
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0
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[
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[
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0.137,
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0.137
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0.00012765,
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[
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0.00100575
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] | 3.315759
| 5.520896
|
pbe
| true
|
0cbb0260cce265dd6590dfe33b2a4299_164_Na3Cd1Os2O8
|
[
"Cd",
"Na",
"Pu",
"Sb"
] | 4
|
ABCD
|
CdNaPuSb
|
Na1 Pu1 Cd1 Sb1
| 4
|
[
1,
1,
1
] | 3
|
[
[
5.3384813,
0,
0
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[
2.66924065,
4.62326042,
0
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[
2.66924065,
1.54108681,
4.35885173
]
] |
agm001327766
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[
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0,
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0
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[
5.3384813,
3.0821736150000003,
2.179425865
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|
[
"Sb",
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"Na",
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] |
2023-11-16 06:57:59
|
[
0.25,
0.25,
0.25,
0.25
] |
[
[
2.736868,
0,
0
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[
0,
2.736868,
0
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[
0,
0,
2.736868
]
] | -21.776074
|
[
-0.062,
0.037,
0.009,
5.578
] |
[
[
0,
0,
0
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[
0,
0,
0
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[
0,
0,
0
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[
0,
0,
0
]
] | 5.984047
| 13.782961
|
pbe
| true
|
a6d017b691b3701db4b5b5af41723dc8_216_Na1Pu1Cd1Sb1
|
[
"Cd",
"Nd",
"Pr",
"Tl"
] | 4
|
ABCD
|
CdNdPrTl
|
Pr1 Nd1 Tl1 Cd1
| 4
|
[
1,
1,
1
] | 3
|
[
[
5.51668023,
0,
0
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[
2.75834012,
4.77758523,
0
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[
2.75834012,
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] |
agm001328712
|
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0,
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[
8.2750203525,
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[
"Pr",
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2023-11-16 06:57:59
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[
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pbe
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8a80f0b3c81a1f52817fd45f77698ce7_216_Pr1Nd1Tl1Cd1
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A4B2CD
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CdNi2PtSc4
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Sc4 Cd1 Ni2 Pt1
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agm004789657
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2023-11-16 06:57:59
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pbe
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0400cb59c33b30b7d5ff73bd862f9a2c_166_Sc4Cd1Ni2Pt1
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A2B2C2D
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Cd2ORb2S2
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Rb2 Cd2 S2 O1
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agm004544404
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[
"Rb",
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2023-11-16 06:57:59
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| true
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1ebbd5ee5ceba95821c558138577b9d7_12_Rb2Cd2S2O1
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ABCD
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CdPrThY
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Pr1 Y1 Th1 Cd1
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agm001316018
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2023-11-16 06:57:59
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pbe
| true
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205a2a8746c778200afaa26178e865c5_216_Pr1Y1Th1Cd1
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A6B2CD
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CdRb2SnTl6
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Rb4 Tl12 Cd2 Sn2
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2023-11-16 06:57:59
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pbe
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47f53e5d62d456a3888e6e2fc5bbabb5_166_Rb4Tl12Cd2Sn2
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A2BCD
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CdRuTc2V
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V1 Cd1 Tc2 Ru1
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agm001501193
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[
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2023-11-16 06:57:59
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[
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pbe
| true
|
7bafea50e2c86c54f66f85f32da7a464_123_V1Cd1Tc2Ru1
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[
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ABCD
|
CeCoLiY
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Li1 Ce1 Y1 Co1
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[
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agm001319464
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[
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2023-11-16 06:57:59
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[
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5349f68a0669a511b2a5d7fb0dcc4743_216_Li1Ce1Y1Co1
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[
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A5B2CD
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Ce2CoN5Ta
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Ce4 Ta2 Co2 N10
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[
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agm005162829
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2.8166271762074087,
1.556144815774283
],
[
-1.571006410554954e-8,
0.6271870756476945,
0.6148384304610129
]
] |
[{"mass": null, "name": "Ta", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ta"]}, {"mass": null, "name": "Ce", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ce"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "N", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["N"]}]
|
[
"Ce",
"Ce",
"Ce",
"Ce",
"Ta",
"Ta",
"Co",
"Co",
"N",
"N",
"N",
"N",
"N",
"N",
"N",
"N",
"N",
"N"
] |
2023-11-16 06:57:59
|
[
0.2222222222222222,
0.1111111111111111,
0.5555555555555556,
0.1111111111111111
] |
[
[
1.2297564,
0,
0
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[
0,
1.1438764,
0
],
[
0,
0,
1.2903701
]
] | -162.854788
|
[
0,
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0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0
] |
[
[
0,
0.00179094,
0.00097319
],
[
0,
-0.00149819,
0.00074243
],
[
0,
-0.00179094,
0.00097319
],
[
0,
0.00149819,
0.00074243
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[
0,
0.00002078,
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[
0,
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[
0,
0.0028274,
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[
0,
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[
0,
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0.00265863
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[
0,
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0,
0.00097685,
0.00195867
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[
0,
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[
0,
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[
0,
-0.00222318,
0.00265863
],
[
0,
0.00167041,
-0.00073199
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[
0,
-0.00097685,
0.00195867
],
[
0,
0.00223006,
-0.00068599
],
[
0,
0.00103855,
-0.00103891
]
] | -0.000003
| 6.433994
|
pbe
| true
|
54c445cb541cccd6f07e33c220ac9c73_36_Ce4Ta2Co2N10
|
[
"Ce",
"Cr",
"O",
"Re"
] | 12
|
A8B2CD
|
CeCr2O8Re
|
Ce1 Cr2 Re1 O8
| 4
|
[
1,
1,
1
] | 3
|
[
[
4.71915644,
-0.03761792,
-0.0029308
],
[
0.00113163,
4.71463327,
-0.0051659
],
[
0.00416199,
0.00721258,
6.47855076
]
] |
agm004905329
|
[
[
0.002080995,
0.00360629,
3.23927538
],
[
2.363301280399372,
2.3439741876024867,
4.89751190252184
],
[
2.3611487796006276,
2.340253742397514,
1.5729421574781601
],
[
0,
0,
0
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[
0.9405978420986865,
3.762527285435219,
1.3830946919759215
],
[
3.3431130575194037,
3.322393574478763,
6.472799645423388
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[
3.7814101441565486,
0.9175125551924395,
1.3844146105132542
],
[
3.783852217901313,
0.9217006445647812,
5.087359368024078
],
[
1.3813370024805962,
1.3618343555212367,
-0.0023455854233878
],
[
0.9430399158434513,
3.766715374807561,
5.086039449486746
],
[
3.2030280173062953,
3.184861669188165,
3.2337291365084893
],
[
1.5214220426937053,
1.4993662608118348,
3.2367249234915105
]
] |
[{"mass": null, "name": "Cr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cr"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "Ce", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ce"]}, {"mass": null, "name": "Re", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Re"]}]
|
[
"Ce",
"Cr",
"Cr",
"Re",
"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O"
] |
2023-11-16 06:57:59
|
[
0.08333333333333333,
0.16666666666666666,
0.6666666666666666,
0.08333333333333333
] |
[
[
1.2631849,
-0.01926079,
-0.00026804
],
[
-0.01926017,
1.3541409,
-0.00059388
],
[
-0.00026804,
-0.00059388,
0.7882322
]
] | -98.231173
|
[
0.185,
3.057,
3.057,
0.663,
0.007,
-0.049,
0.007,
0.007,
-0.049,
0.007,
-0.056,
-0.056
] |
[
[
0,
0,
0
],
[
0.00000107,
0.00000185,
0.00165866
],
[
-0.00000107,
-0.00000185,
-0.00165866
],
[
0,
0,
0
],
[
0.0022393,
0.00324645,
0.00063341
],
[
0.00001596,
-0.00445693,
0.00000487
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[
-0.00223848,
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0.00064334
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[
-0.0022393,
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-0.00063341
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[
-0.00001596,
0.00445693,
-0.00000487
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[
0.00223848,
0.00324503,
-0.00064334
],
[
0.00304164,
-0.00322451,
0.00000162
],
[
-0.00304164,
0.00322451,
-0.00000162
]
] | 7.050707
| 2.263266
|
pbe
| true
|
1603a279af2af3dda3bf0fb94b64a20b_10_Ce1Cr2Re1O8
|
[
"Ce",
"Cu",
"Pt",
"Th"
] | 4
|
ABCD
|
CeCuPtTh
|
Ce1 Th1 Cu1 Pt1
| 4
|
[
1,
1,
1
] | 3
|
[
[
3.8513824,
0,
0
],
[
0,
4.41696648,
0
],
[
-1.9256912,
0,
5.59666888
]
] |
agm005205427
|
[
[
1.9256911999999997,
2.20848324,
4.030003210558829
],
[
4.446901479650478e-17,
0,
1.5561949735669567
],
[
-1.925691194406823e-8,
0,
4.719572197231646
],
[
1.9256912000000002,
2.20848324,
0.88757851601364
]
] |
[{"mass": null, "name": "Ce", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ce"]}, {"mass": null, "name": "Cu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cu"]}, {"mass": null, "name": "Th", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Th"]}, {"mass": null, "name": "Pt", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pt"]}]
|
[
"Ce",
"Th",
"Cu",
"Pt"
] |
2023-11-16 06:57:59
|
[
0.25,
0.25,
0.25,
0.25
] |
[
[
-0.9643389,
0,
0
],
[
0,
-0.6364339,
0
],
[
0,
0,
-1.0531147
]
] | -25.964999
|
[
0.724,
0.06,
0.008,
-0.002
] |
[
[
0,
0,
-0.00183009
],
[
0,
0,
-0.00152397
],
[
0,
0,
0.00464932
],
[
0,
0,
-0.00129526
]
] | 1.051289
| 6.807545
|
pbe
| true
|
1b4047caedbf6ea439c170b3c403ff9f_38_Ce1Th1Cu1Pt1
|
[
"Ce",
"Dy",
"Er",
"P"
] | 8
|
A4B2CD
|
CeDyEr2P4
|
Ce1 Dy1 Er2 P4
| 4
|
[
1,
1,
1
] | 3
|
[
[
4.00779824,
0,
0
],
[
0,
6.93243163,
0.12475024
],
[
0,
-2.42012158,
6.49175236
]
] |
agm004846531
|
[
[
2.00389912,
3.466215815,
0.06237512
],
[
0,
0,
0
],
[
2.00389912,
-1.21006079,
3.24587618
],
[
0,
2.256155025,
3.3082513000000002
],
[
2.00389912,
1.1263304670412064,
1.671025286060654
],
[
2.00389912,
3.3859795829587935,
4.945477313939346
],
[
0,
-0.08977072518380141,
4.871922228302831
],
[
0,
4.602080775183801,
1.7445803716971697
]
] |
[{"mass": null, "name": "Ce", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ce"]}, {"mass": null, "name": "Er", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Er"]}, {"mass": null, "name": "Dy", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Dy"]}, {"mass": null, "name": "P", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["P"]}]
|
[
"Ce",
"Dy",
"Er",
"Er",
"P",
"P",
"P",
"P"
] |
2023-11-16 06:57:59
|
[
0.125,
0.125,
0.25,
0.5
] |
[
[
0.6511472,
0,
0
],
[
0,
0.7528823,
-0.08540616
],
[
0,
-0.08540614,
0.6542034
]
] | -53.994685
|
[
0.362,
0.004,
0.006,
0.003,
-0.005,
-0.005,
-0.01,
-0.01
] |
[
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0.00122121,
-0.0007622
],
[
0,
-0.00122121,
0.0007622
],
[
0,
0.00091567,
0.00293733
],
[
0,
-0.00091567,
-0.00293733
]
] | 0.401022
| 5.325027
|
pbe
| true
|
b2b031d1a3ed2fcf2ea56f9b2f8bf234_10_Ce1Dy1Er2P4
|
[
"Ce",
"Dy",
"N",
"Pu"
] | 8
|
A4B2CD
|
CeDyN4Pu2
|
Ce1 Dy1 Pu2 N4
| 4
|
[
1,
1,
1
] | 3
|
[
[
3.50551921,
0,
0
],
[
0,
6.07231166,
0.07596155
],
[
0,
-2.14537226,
5.65248945
]
] |
agm004848681
|
[
[
0,
0,
0
],
[
1.752759605,
3.03615583,
0.037980775
],
[
1.752759605,
-1.07268613,
2.826244725
],
[
0,
1.9634697000000003,
2.8642255
],
[
1.752759605,
1.0291542730417196,
1.4769941866494896
],
[
1.752759605,
2.897785126958281,
4.251456813350511
],
[
0,
-0.09334893718416087,
4.207860186934919
],
[
0,
4.020288337184161,
1.520590813065081
]
] |
[{"mass": null, "name": "Ce", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ce"]}, {"mass": null, "name": "Dy", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Dy"]}, {"mass": null, "name": "Pu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pu"]}, {"mass": null, "name": "N", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["N"]}]
|
[
"Ce",
"Dy",
"Pu",
"Pu",
"N",
"N",
"N",
"N"
] |
2023-11-16 06:57:59
|
[
0.125,
0.125,
0.5,
0.25
] |
[
[
0.8073046,
0,
0
],
[
0,
0.5497693,
-0.14566922
],
[
0,
-0.14566897,
0.7558147
]
] | -83.584315
|
[
0.011,
-0.016,
4.527,
-4.48,
0.068,
0.068,
-0.055,
-0.055
] |
[
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0.00221098,
0.00434785
],
[
0,
-0.00221098,
-0.00434785
],
[
0,
0.00170237,
-0.00097171
],
[
0,
-0.00170237,
0.00097171
]
] | 0.045246
| 14.716906
|
pbe
| true
|
1451f754130ff93b06f121982fc0cd29_10_Ce1Dy1Pu2N4
|
[
"Ce",
"Ga",
"Hf",
"Zn"
] | 4
|
ABCD
|
CeGaHfZn
|
Ce1 Hf1 Zn1 Ga1
| 4
|
[
1,
1,
1
] | 3
|
[
[
4.91190105,
0,
0
],
[
2.45595053,
4.25383109,
0
],
[
2.45595053,
1.4179437,
4.01055042
]
] |
agm001360178
|
[
[
7.3678515825,
4.2538310925000005,
3.007912815
],
[
4.9119010549999995,
2.8358873950000003,
2.00527521
],
[
2.4559505274999998,
1.4179436975000002,
1.002637605
],
[
0,
0,
0
]
] |
[{"mass": null, "name": "Hf", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Hf"]}, {"mass": null, "name": "Ce", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ce"]}, {"mass": null, "name": "Zn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zn"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Zn",
"Hf",
"Ga",
"Ce"
] |
2023-11-16 06:57:59
|
[
0.25,
0.25,
0.25,
0.25
] |
[
[
4.087706,
0,
0
],
[
0,
4.087706,
0
],
[
0,
0,
4.087706
]
] | -21.176627
|
[
0.007,
0.126,
0.003,
0.541
] |
[
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | 0.823012
| 6.270387
|
pbe
| true
|
af0a59798f2cd8e6980389ddcc7bc1cf_216_Ce1Hf1Zn1Ga1
|
[
"Ce",
"Gd",
"Pr",
"Tl"
] | 4
|
ABCD
|
CeGdPrTl
|
Ce1 Pr1 Gd1 Tl1
| 4
|
[
1,
1,
1
] | 3
|
[
[
5.52670953,
0,
0
],
[
2.76335476,
4.78627085,
0
],
[
2.76335476,
1.59542362,
4.51253943
]
] |
agm001394507
|
[
[
8.2900642875,
4.7862708524999995,
3.3844045725000003
],
[
0,
0,
0
],
[
2.7633547625,
1.5954236175,
1.1281348575
],
[
5.526709525,
3.190847235,
2.256269715
]
] |
[{"mass": null, "name": "Gd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Gd"]}, {"mass": null, "name": "Tl", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tl"]}, {"mass": null, "name": "Ce", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ce"]}, {"mass": null, "name": "Pr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pr"]}]
|
[
"Pr",
"Tl",
"Gd",
"Ce"
] |
2023-11-16 06:57:59
|
[
0.25,
0.25,
0.25,
0.25
] |
[
[
1.7948703,
0,
0
],
[
0,
1.7948703,
0
],
[
0,
0,
1.7948703
]
] | -27.181914
|
[
0.292,
-0.032,
7.483,
1.28
] |
[
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | 10.432802
| 10.208962
|
pbe
| true
|
a7d1102a70f6ab3fe47a4c7adaa0bcdd_216_Ce1Pr1Gd1Tl1
|
[
"Ce",
"Ge",
"I",
"Pm"
] | 4
|
ABCD
|
CeGeIPm
|
Ce1 Pm1 Ge1 I1
| 4
|
[
1,
1,
1
] | 3
|
[
[
4.28290681,
-0.0005604,
-0.00032094
],
[
-2.1409963,
3.71002323,
0.00016155
],
[
-2.14105521,
-1.23587246,
7.77791989
]
] |
agm005196795
|
[
[
-1.7365884446575643,
3.438799990976417,
0.5310595606718734
],
[
0.40471936769588956,
-0.2712069561600871,
5.175249598171222
],
[
-1.7362855921460913,
0.965855529188466,
6.779173981185945
],
[
2.5459392980566826,
0.9655656743912759,
2.834100010798349
]
] |
[{"mass": null, "name": "Ge", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ge"]}, {"mass": null, "name": "Ce", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ce"]}, {"mass": null, "name": "I", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["I"]}, {"mass": null, "name": "Pm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pm"]}]
|
[
"Ce",
"Pm",
"Ge",
"I"
] |
2023-11-16 06:57:59
|
[
0.25,
0.25,
0.25,
0.25
] |
[
[
1.7929887,
0.00511681,
0.00889763
],
[
0.00511677,
1.7948124,
-0.01485827
],
[
0.00889765,
-0.01485842,
1.8029528
]
] | -20.525477
|
[
0.784,
-0.002,
-0.02,
-0.006
] |
[
[
0.00014399,
-0.00009572,
0.00022042
],
[
-0.00005481,
0.00048758,
-0.00426378
],
[
-0.00003444,
0.00053117,
0.00172614
],
[
-0.00005475,
-0.00092303,
0.00231722
]
] | 0.880908
| 7.865752
|
pbe
| true
|
e76b01f795e2a3074d307d4969f48470_160_Ce1Pm1Ge1I1
|
[
"Ce",
"Hf",
"K",
"S"
] | 12
|
A6B3C2D
|
Ce2HfK3S6
|
K3 Ce2 Hf1 S6
| 4
|
[
1,
1,
1
] | 3
|
[
[
7.00057211,
-0.00100039,
-0.00276177
],
[
-3.49944866,
6.06315676,
-0.00276177
],
[
-1.17055566,
-2.02680412,
7.39650847
]
] |
agm004643365
|
[
[
-2.3075123995082247,
4.023346679481728,
3.6954924649999996
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[
4.638080189508225,
0.012005570518272446,
3.6954924649999996
],
[
1.165283895,
2.0176761250000004,
3.6954924649999996
],
[
0.003081803325126041,
4.04031360401776,
-0.00276177
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[
3.4980416466748743,
2.0218427659822407,
-0.00276177
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[
0,
0,
0
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[
3.4106391547218973,
2.164976230193079,
5.893323624795849
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[
2.4228457708414757,
4.1951305449695795,
1.4944460307243008
],
[
-1.0800713647218971,
1.8703760198069208,
1.4976613052041499
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[
0.17073909590369607,
4.036140443801375,
5.893323624795849
],
[
-0.09227798084147582,
-0.1597782949695795,
5.896538899275699
],
[
2.1598286940963045,
-0.0007881938013742269,
1.4976613052041499
]
] |
[{"mass": null, "name": "Hf", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Hf"]}, {"mass": null, "name": "S", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["S"]}, {"mass": null, "name": "Ce", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ce"]}, {"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}]
|
[
"K",
"K",
"K",
"Ce",
"Ce",
"Hf",
"S",
"S",
"S",
"S",
"S",
"S"
] |
2023-11-16 06:57:59
|
[
0.16666666666666666,
0.08333333333333333,
0.25,
0.5
] |
[
[
0.8953738,
0.00378096,
-0.00452216
],
[
0.00378096,
0.8997368,
-0.00783007
],
[
-0.00452212,
-0.00783,
0.7911937
]
] | -69.823738
|
[
0.003,
0.003,
0.003,
1.015,
1.015,
0.286,
-0.017,
-0.017,
-0.017,
-0.017,
-0.017,
-0.017
] |
[
[
-0.00283731,
0.00163865,
0
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[
0.00283731,
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0
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[
0,
0,
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[
-0.00094815,
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0
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0.00094815,
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[
0,
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0
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[
-0.00010835,
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[
-0.00064726,
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0.00041985
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[
0.00010835,
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[
-0.00062558,
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-0.0023365
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[
0.00064726,
0.00112073,
-0.00041985
],
[
0.00062558,
0.00048604,
0.0023365
]
] | 2.911792
| 15.386153
|
pbe
| true
|
a9c3c46bf10c2f8efce2b57d9eebc853_12_K3Ce2Hf1S6
|
[
"Ce",
"Hg",
"Pd",
"Tl"
] | 4
|
ABCD
|
CeHgPdTl
|
Ce1 Tl1 Hg1 Pd1
| 4
|
[
1,
1,
1
] | 3
|
[
[
5.09467698,
0,
0
],
[
2.54733849,
4.41211969,
0
],
[
2.54733849,
1.47070656,
4.15978634
]
] |
agm001391986
|
[
[
0,
0,
0
],
[
7.6420154700000005,
4.4121196875,
3.119839755
],
[
2.54733849,
1.4707065625,
1.039946585
],
[
5.09467698,
2.941413125,
2.07989317
]
] |
[{"mass": null, "name": "Hg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Hg"]}, {"mass": null, "name": "Tl", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tl"]}, {"mass": null, "name": "Ce", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ce"]}, {"mass": null, "name": "Pd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pd"]}]
|
[
"Tl",
"Pd",
"Hg",
"Ce"
] |
2023-11-16 06:57:59
|
[
0.25,
0.25,
0.25,
0.25
] |
[
[
4.2390833,
0,
0
],
[
0,
4.2390833,
0
],
[
0,
0,
4.2390833
]
] | -15.292
|
[
-0.004,
-0.025,
-0.006,
0.671
] |
[
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | 0.692753
| 6.156964
|
pbe
| true
|
291080949c163204bf31b6a1e3e70c19_216_Ce1Tl1Hg1Pd1
|
[
"Ce",
"Hg",
"Sb",
"Th"
] | 4
|
ABCD
|
CeHgSbTh
|
Ce1 Th1 Hg1 Sb1
| 4
|
[
1,
1,
1
] | 3
|
[
[
5.42943932,
0,
0
],
[
2.71471966,
4.70203238,
0
],
[
2.71471966,
1.56734413,
4.43311864
]
] |
agm001398674
|
[
[
5.42943932,
3.1346882550000004,
2.21655932
],
[
2.71471966,
1.5673441275000002,
1.10827966
],
[
0,
0,
0
],
[
8.14415898,
4.7020323825000006,
3.32483898
]
] |
[{"mass": null, "name": "Hg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Hg"]}, {"mass": null, "name": "Ce", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ce"]}, {"mass": null, "name": "Sb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sb"]}, {"mass": null, "name": "Th", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Th"]}]
|
[
"Sb",
"Ce",
"Hg",
"Th"
] |
2023-11-16 06:57:59
|
[
0.25,
0.25,
0.25,
0.25
] |
[
[
1.7164347,
0,
0
],
[
0,
1.7164347,
0
],
[
0,
0,
1.7164347
]
] | -19.678557
|
[
0.008,
0.948,
0.029,
0.259
] |
[
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | 1.822182
| 9.744431
|
pbe
| true
|
18318e0fda16bf781b347d785e502891_216_Ce1Th1Hg1Sb1
|
[
"Ce",
"K",
"O",
"Pd"
] | 8
|
A4B2CD
|
CeK2O4Pd
|
K2 Ce1 Pd1 O4
| 4
|
[
1,
1,
1
] | 3
|
[
[
5.70511449,
0.12601095,
0.19305222
],
[
-2.31690397,
5.21499453,
-0.19304723
],
[
-2.3169109,
-2.27541362,
4.69637051
]
] |
agm004765166
|
[
[
0.5356515425000001,
3.4053979675000003,
1.1258333150000002
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[
0,
0,
0
],
[
0.5356480774999999,
-0.33980610750000007,
3.5705421850000003
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[
-2.316907435,
1.469790455,
2.25166164
],
[
1.682134019195312,
0.5442553548757897,
1.9700049275942455
],
[
-1.60026701201014,
-0.07850859429835601,
3.4053374270935626
],
[
3.1638401169116106,
2.83181775609529,
0.812624897483364
],
[
-1.1031078840897828,
2.833626768639508,
3.2047788095169114
]
] |
[{"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "Ce", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ce"]}, {"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}, {"mass": null, "name": "Pd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pd"]}]
|
[
"K",
"K",
"Ce",
"Pd",
"O",
"O",
"O",
"O"
] |
2023-11-16 06:57:59
|
[
0.125,
0.25,
0.5,
0.125
] |
[
[
0.58228785,
0.13345271,
0.20444877
],
[
0.13345675,
0.70799905,
-0.12969448
],
[
0.20444614,
-0.12969863,
0.59396946
]
] | -47.564877
|
[
0,
0,
0,
0,
0,
0,
0,
0
] |
[
[
0,
0,
0
],
[
0,
0,
0
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[
0,
0,
0
],
[
0,
0,
0
],
[
0.00098247,
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0.00106916
],
[
0.00177444,
0.00192173,
0.00285763
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[
-0.00366784,
-0.0007206,
-0.00101755
],
[
0.00091093,
0.00239044,
-0.00290925
]
] | -0
| -0.04196
|
pbe
| true
|
07da6482c656b955851c2f564e0898a4_82_K2Ce1Pd1O4
|
[
"Ce",
"Ir",
"Se",
"Te"
] | 12
|
A6B3C2D
|
Ce6Ir2SeTe3
|
Ce6 Te3 Ir2 Se1
| 4
|
[
1,
1,
1
] | 3
|
[
[
4.21325023,
0,
0
],
[
0,
8.90064739,
0.10857382
],
[
-2.10662511,
-2.78134517,
9.12407585
]
] |
agm004603939
|
[
[
-1.7728144852255704e-8,
5.99386158860904,
6.187193799780011
],
[
2.1066230312098226,
4.022664965551812,
3.288597984138311
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[
2.106625137728145,
0.12544063139096004,
3.0454558702199903
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[
0.000002106772477504275,
2.110691498291546,
0.295656366614923
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[
2.1066230132275225,
4.008610721708454,
8.936993303385078
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[
0.000002088790177219655,
2.0966372544481877,
5.94405168586169
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[
2.106625115,
4.450323695,
0.05428691
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[
2.106625097327729,
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6.211040049788753
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[
2.267227080763098e-8,
6.560095487358763,
3.0216096202112475
],
[
2.106625139385367,
4.067108769157005,
6.128906715820617
],
[
-1.9385366566172597e-8,
2.0521934508429958,
3.1037429541793835
],
[
2.106625115,
0,
0
]
] |
[{"mass": null, "name": "Ce", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ce"]}, {"mass": null, "name": "Se", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Se"]}, {"mass": null, "name": "Te", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Te"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
|
[
"Ce",
"Ce",
"Ce",
"Ce",
"Ce",
"Ce",
"Te",
"Te",
"Te",
"Ir",
"Ir",
"Se"
] |
2023-11-16 06:57:59
|
[
0.5,
0.16666666666666666,
0.08333333333333333,
0.25
] |
[
[
2.0893612,
0,
0
],
[
0,
2.2911777,
-0.07491383
],
[
0,
-0.07491384,
2.1792562
]
] | -80.973266
|
[
0.818,
0.768,
0.818,
0.878,
0.878,
0.768,
-0.021,
-0.022,
-0.022,
-0.052,
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-0.023
] |
[
[
0,
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[
0,
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0.00180147
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[
0,
0.00582124,
0.00109294
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[
0,
0.00190299,
0.00648352
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[
0,
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[
0,
0.00248111,
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[
0,
0,
0
],
[
0,
-0.00647364,
0.00038549
],
[
0,
0.00647364,
-0.00038549
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[
0,
-0.00321805,
-0.00399936
],
[
0,
0.00321805,
0.00399936
],
[
0,
0,
0
]
] | 6.05708
| 34.891613
|
pbe
| true
|
683b001afcb7ef5736d15b1635b8930a_12_Ce6Te3Ir2Se1
|
[
"Ce",
"Mg",
"O",
"Pu"
] | 18
|
A6BCD
|
CeMgO6Pu
|
Ce2 Pu2 Mg2 O12
| 4
|
[
1,
1,
1
] | 3
|
[
[
5.39379759,
0,
0
],
[
-2.6968988,
4.67116574,
0
],
[
0,
0,
9.8684776
]
] |
agm005082521
|
[
[
0,
0,
0
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[
0,
0,
4.9342388
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[
2.6968988203023216,
1.557055231096114,
2.4671194
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[
-3.0302321460777395e-8,
3.114110508903886,
7.401358200000001
],
[
-3.0302321460777395e-8,
3.114110508903886,
2.4671194
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[
2.6968988203023216,
1.557055231096114,
7.401358200000001
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[
1.7946284571526372,
3.0337530986418693,
1.342844306474936
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[
4.426894509863748,
1.6000906810587343,
1.342844306474936
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4.633853122032084,
6.277083106474937
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[
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3.071075058941266,
8.525633293525065
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0.966903076710788,
1.6000906810587343,
3.5913944935250637
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[
3.5991691263527246,
3.0337530986418693,
3.5913944935250637
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[
0.8277253770163759,
4.633853122032084,
8.525633293525065
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[
3.524624176936497,
0.0373126179679164,
3.5913944935250637
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[
-0.9022703363527247,
1.6374126413581307,
6.277083106474937
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[
1.8691734129836242,
0.0373126179679164,
1.342844306474936
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[
1.729995713289212,
3.071075058941266,
6.277083106474937
],
[
0.9022703328473625,
1.6374126413581307,
8.525633293525065
]
] |
[{"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "Ce", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ce"]}, {"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Pu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pu"]}]
|
[
"Ce",
"Ce",
"Pu",
"Pu",
"Mg",
"Mg",
"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O"
] |
2023-11-16 06:57:59
|
[
0.1111111111111111,
0.1111111111111111,
0.6666666666666666,
0.1111111111111111
] |
[
[
0.5417302,
0,
0
],
[
0,
0.5417302,
0
],
[
0,
0,
1.2224693
]
] | -153.623142
|
[
0.155,
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2.356,
2.356,
0,
0,
-0.075,
-0.075,
-0.075,
-0.075,
-0.075,
-0.075,
-0.075,
-0.075,
-0.075,
-0.075,
-0.075,
-0.075
] |
[
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
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[
0,
0,
0
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[
0,
0,
0
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[
0,
0,
0
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[
0.00310898,
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0.00165896
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[
-0.00197512,
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0.00165896
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[
0.00113386,
0.00293531,
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[
0.00113386,
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[
-0.00310898,
0.0004857,
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[
0.00197512,
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[
0.00197512,
0.0024496,
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[
0.00310898,
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0.00165896
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[
-0.00197512,
0.0024496,
0.00165896
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[
-0.00113386,
0.00293531,
0.00165896
],
[
-0.00310898,
-0.0004857,
-0.00165896
]
] | 4.070279
| 15.708221
|
pbe
| true
|
670c6207ee03731b14a18ce4884dfc03_163_Ce2Pu2Mg2O12
|
[
"Ce",
"N",
"Pa",
"V"
] | 14
|
A4BCD
|
CeN4PaV
|
Ce2 Pa2 V2 N8
| 4
|
[
1,
1,
1
] | 3
|
[
[
5.83020852,
0,
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[
0,
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0
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[
-2.1845433,
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agm005055826
|
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[
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1.3819271575,
2.773787927977433
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[{"mass": null, "name": "Ce", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ce"]}, {"mass": null, "name": "Pa", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pa"]}, {"mass": null, "name": "N", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["N"]}, {"mass": null, "name": "V", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["V"]}]
|
[
"Ce",
"Ce",
"Pa",
"Pa",
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"V",
"N",
"N",
"N",
"N",
"N",
"N",
"N",
"N"
] |
2023-11-16 06:57:59
|
[
0.14285714285714285,
0.5714285714285714,
0.14285714285714285,
0.14285714285714285
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[
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0
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0.05587758,
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[
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[
-0.00059666,
0,
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] | 3.697045
| 15.790748
|
pbe
| true
|
58c46b28b0f50297396f616783cb39ce_11_Ce2Pa2V2N8
|
[
"Ce",
"Rb",
"Se",
"Ti"
] | 11
|
A6B2C2D
|
Ce2Rb2Se6Ti
|
Rb2 Ce2 Ti1 Se6
| 4
|
[
1,
1,
1
] | 3
|
[
[
7.12340181,
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6.20228338,
0.05267633
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agm004580192
|
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2.6141006447159123
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[
0.7927307975300105,
5.104828151240862,
2.6141006447159123
]
] |
[{"mass": null, "name": "Ce", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ce"]}, {"mass": null, "name": "Se", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Se"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}, {"mass": null, "name": "Ti", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ti"]}]
|
[
"Rb",
"Rb",
"Ce",
"Ce",
"Ti",
"Se",
"Se",
"Se",
"Se",
"Se",
"Se"
] |
2023-11-16 06:57:59
|
[
0.18181818181818182,
0.18181818181818182,
0.5454545454545454,
0.09090909090909091
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[
[
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[
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0.01186371
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[
0.00690194,
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0.8451604
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[
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0.692,
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0.623,
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[
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[
0.00069634,
0.00196687,
0.00101641
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[
0.00136566,
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0.00101641
]
] | 2.009687
| 14.723526
|
pbe
| true
|
6adbca592580cd6bd8b1bf42e25a5541_12_Rb2Ce2Ti1Se6
|
[
"Cl",
"Co",
"Li",
"Na"
] | 12
|
A8B2CD
|
Cl8Co2LiNa
|
Na1 Li1 Co2 Cl8
| 4
|
[
1,
1,
1
] | 3
|
[
[
6.29535061,
0.00000235,
0
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[
3.14767328,
5.45193473,
0
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[
3.14767463,
1.81731236,
9.0126931
]
] |
agm004895583
|
[
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[
0,
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[
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[
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7.438336852509559
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[
7.356974042503169,
5.4383819948609595,
7.438336852509559
]
] |
[{"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Na", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Na"]}, {"mass": null, "name": "Cl", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cl"]}]
|
[
"Na",
"Li",
"Co",
"Co",
"Cl",
"Cl",
"Cl",
"Cl",
"Cl",
"Cl",
"Cl",
"Cl"
] |
2023-11-16 06:57:59
|
[
0.6666666666666666,
0.16666666666666666,
0.08333333333333333,
0.08333333333333333
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[
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0
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[
-9.3e-7,
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0
],
[
0,
0,
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]
] | -42.734166
|
[
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2.661,
2.661,
0.25,
0.23,
0.25,
0.23,
0.23,
0.23,
0.23,
0.23
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[
[
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[
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0
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[
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[
0,
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[
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[
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[
0.0006587,
0.00140819,
0.00300224
],
[
-0.00154888,
-0.00013364,
0.00300224
]
] | 8.000504
| 11.724005
|
pbe
| true
|
ddadd1d8feb97354703f0a798ef6b4cc_148_Na1Li1Co2Cl8
|
[
"Cl",
"Cs",
"K",
"Tl"
] | 5
|
A2BCD
|
ClCsK2Tl
|
Cs1 K2 Tl1 Cl1
| 4
|
[
1,
1,
1
] | 3
|
[
[
6.11599229,
0,
0
],
[
0,
6.11599229,
0
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[
0,
0,
6.78248253
]
] |
agm001629696
|
[
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0,
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3.391241265
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[
3.057996145,
3.057996145,
3.391241265
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[
0,
3.057996145,
0
],
[
3.057996145,
0,
0
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[
0,
0,
0
]
] |
[{"mass": null, "name": "Tl", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tl"]}, {"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}, {"mass": null, "name": "Cl", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cl"]}, {"mass": null, "name": "Cs", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cs"]}]
|
[
"Cs",
"Tl",
"K",
"K",
"Cl"
] |
2023-11-16 06:57:59
|
[
0.2,
0.2,
0.4,
0.2
] |
[
[
0.87611365,
0,
0
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[
0,
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0
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[
0,
0,
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]
] | -10.672831
|
[
0,
0,
0,
0,
0
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[
[
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0
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[
0,
0,
0
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[
0,
0,
0
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[
0,
0,
0
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[
0,
0,
0
]
] | 0.000001
| 4.058666
|
pbe
| true
|
49f7b4d4e50348da200dffad0dbbaec0_123_Cs1K2Tl1Cl1
|
[
"Cl",
"Cs",
"La",
"Li"
] | 11
|
A6B2C2D
|
Cl6Cs2LaLi2
|
Cs2 Li2 La1 Cl6
| 4
|
[
1,
1,
1
] | 3
|
[
[
7.28491522,
0,
0
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[
-3.64245761,
6.36009527,
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[
0,
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8.15014843
]
] |
agm004578873
|
[
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[
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6.378682758420433
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[
5.3415138336885875,
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6.378682758420433
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[
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4.987982781185415,
1.6124870015795663
],
[
-0.0000036424576101330443,
1.738217141271023,
3.183618100600704
]
] |
[{"mass": null, "name": "La", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["La"]}, {"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Cl", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cl"]}, {"mass": null, "name": "Cs", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cs"]}]
|
[
"Cs",
"Cs",
"Li",
"Li",
"La",
"Cl",
"Cl",
"Cl",
"Cl",
"Cl",
"Cl"
] |
2023-11-16 06:57:59
|
[
0.5454545454545454,
0.18181818181818182,
0.09090909090909091,
0.18181818181818182
] |
[
[
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0,
0
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[
0,
-0.20302518,
-0.0781098
],
[
0,
-0.0781098,
-0.1084995
]
] | -42.391613
|
[
0.007,
0.007,
0.026,
0.026,
0.331,
0.001,
0.011,
0.011,
0.011,
0.011,
0.001
] |
[
[
0,
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[
0,
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[
0,
0.00448385,
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[
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[
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[
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[
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[
0.00095934,
-0.00215094,
-0.000268
],
[
0,
-0.00288125,
-0.00180274
]
] | 1.097666
| 0.77153
|
pbe
| true
|
7f1cc68da2ac3bbacc3b7ac483eb1cfe_12_Cs2Li2La1Cl6
|
[
"Cl",
"Cs",
"N",
"Nb"
] | 5
|
A2BCD
|
ClCsNNb2
|
Cs1 Nb2 N1 Cl1
| 4
|
[
1,
1,
1
] | 3
|
[
[
5.23457942,
0,
0
],
[
0,
5.52416668,
0
],
[
0,
0,
5.23457942
]
] |
agm001573081
|
[
[
0,
0,
0
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[
0,
0,
2.61728971
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[
2.61728971,
0,
0
],
[
2.61728971,
2.76208334,
2.61728971
],
[
0,
2.76208334,
0
]
] |
[{"mass": null, "name": "Nb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nb"]}, {"mass": null, "name": "N", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["N"]}, {"mass": null, "name": "Cl", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cl"]}, {"mass": null, "name": "Cs", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cs"]}]
|
[
"Cs",
"Nb",
"Nb",
"N",
"Cl"
] |
2023-11-16 06:57:59
|
[
0.2,
0.2,
0.2,
0.4
] |
[
[
32.731316,
0,
0
],
[
0,
0.87284356,
0
],
[
0,
0,
32.731316
]
] | -14.184273
|
[
0.106,
1.666,
1.616,
-0.025,
0.095
] |
[
[
0,
0,
0
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[
0,
0,
0
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[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | 4.327306
| 12.91878
|
pbe
| true
|
4703ec587400d0950e1d00be42b9c08a_123_Cs1Nb2N1Cl1
|
[
"Cl",
"Cu",
"Os",
"V"
] | 5
|
A2BCD
|
Cl2CuOsV
|
V1 Cu1 Os1 Cl2
| 4
|
[
1,
1,
1
] | 3
|
[
[
4.17701462,
0,
0
],
[
0,
6.50752625,
0
],
[
0,
0,
4.17701462
]
] |
agm001513463
|
[
[
0,
0,
2.08850731
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[
2.08850731,
0,
0
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[
2.08850731,
3.253763125,
2.08850731
],
[
0,
0,
0
],
[
0,
3.253763125,
0
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2023-11-16 06:57:59
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pbe
| true
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a351226591b5e9a312c5477512d622d3_123_V1Cu1Os1Cl2
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[
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A8B2CD
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Cl8DyMg2Rb
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Rb1 Dy1 Mg2 Cl8
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agm004914223
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2023-11-16 06:57:59
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pbe
| true
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5afbdb7e04a0089b7b46ff1a89ea2080_2_Rb1Dy1Mg2Cl8
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A2BCD
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Cl2FeMoP
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Fe1 Mo1 P1 Cl2
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agm001688000
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2023-11-16 06:57:59
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| true
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38cf3c15f1d27f1f6a57ad3d6a676adb_123_Fe1Mo1P1Cl2
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A8B3C3D
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Cl3HIr3Pr8
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Pr8 H1 Ir3 Cl3
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agm004693237
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2023-11-16 06:57:59
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pbe
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91afb56f8e549bb5a3f11ec1d3bf301d_166_Pr8H1Ir3Cl3
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A6B5C2D
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Cl6H5O2Sb
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Cl12 H10 O4 Sb2
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mp-1192718
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2019-01-11 22:41:12
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| true
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A6B2CD
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Cl6HgKLi2
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K2 Li4 Hg2 Cl12
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agm004980137
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[
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5.134093024072279
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[{"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Hg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Hg"]}, {"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}, {"mass": null, "name": "Cl", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cl"]}]
|
[
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"Cl",
"Cl",
"Cl",
"Cl",
"Cl",
"Cl",
"Cl"
] |
2023-11-16 06:57:59
|
[
0.6,
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0.2
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[
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| -0.266093
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pbe
| true
|
479c069f651baa6d85bc603ba4c85ad3_15_K2Li4Hg2Cl12
|
[
"Cl",
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] | 18
|
A6BCD
|
Cl6HoKMn
|
K2 Ho2 Mn2 Cl12
| 4
|
[
1,
1,
1
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[
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agm005091942
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12.14407300119754
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|
[
"K",
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"Cl",
"Cl",
"Cl",
"Cl",
"Cl",
"Cl",
"Cl",
"Cl",
"Cl",
"Cl",
"Cl"
] |
2023-11-16 06:57:59
|
[
0.6666666666666666,
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| 17.680521
|
pbe
| true
|
1d3f8a917e6d32ae28b4cfc808a8a154_163_K2Ho2Mn2Cl12
|
[
"Cl",
"I",
"O",
"Sb"
] | 5
|
A2BCD
|
ClIO2Sb
|
Sb1 I1 Cl1 O2
| 4
|
[
1,
1,
1
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|
[
[
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0
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[
0,
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[
0,
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agm001745093
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[
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2.02313646,
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[{"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "Cl", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cl"]}, {"mass": null, "name": "Sb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sb"]}, {"mass": null, "name": "I", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["I"]}]
|
[
"I",
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2023-11-16 06:57:59
|
[
0.2,
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0.2
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[
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[
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[
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[
0,
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0,
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| 1.742925
|
pbe
| true
|
f8a8a346a5cb40cd5771f4adca5dced8_123_Sb1I1Cl1O2
|
[
"Cl",
"In",
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"Re"
] | 5
|
A2BCD
|
Cl2InPRe
|
In1 Re1 P1 Cl2
| 4
|
[
1,
1,
1
] | 3
|
[
[
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0,
0
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[
0,
4.96459302,
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[
0,
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agm001688387
|
[
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[
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[
0,
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[{"mass": null, "name": "Cl", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cl"]}, {"mass": null, "name": "Re", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Re"]}, {"mass": null, "name": "In", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["In"]}, {"mass": null, "name": "P", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["P"]}]
|
[
"Re",
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2023-11-16 06:57:59
|
[
0.4,
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0.2
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[
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[
0,
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0,
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|
[
4.104,
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0.001
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[
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[
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0,
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| 1.672782
|
pbe
| true
|
9dd492da908d29f38bfa6397c6d64dc6_123_In1Re1P1Cl2
|
[
"Cl",
"K",
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"Pr"
] | 18
|
A6BCD
|
Cl6KMgPr
|
K2 Pr2 Mg2 Cl12
| 4
|
[
1,
1,
1
] | 3
|
[
[
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agm005074102
|
[
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11.717458854795305
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[{"mass": null, "name": "Pr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pr"]}, {"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}, {"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Cl", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cl"]}]
|
[
"K",
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"Cl",
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2023-11-16 06:57:59
|
[
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[
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[
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0.00251183,
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| 0
|
pbe
| true
|
09899f20b6b6c11beb853cdb3bc75c1a_163_K2Pr2Mg2Cl12
|
[
"Cl",
"K",
"Mg",
"Pt"
] | 5
|
A2BCD
|
ClKMgPt2
|
K1 Mg1 Pt2 Cl1
| 4
|
[
1,
1,
1
] | 3
|
[
[
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0
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[
0,
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[
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agm001508440
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[
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[{"mass": null, "name": "Cl", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cl"]}, {"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}, {"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Pt", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pt"]}]
|
[
"K",
"Mg",
"Pt",
"Pt",
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] |
2023-11-16 06:57:59
|
[
0.2,
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0.2,
0.4
] |
[
[
3.7847645,
0,
0
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[
0,
2.16626,
0
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[
0,
0,
3.7847645
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] | -9.454788
|
[
0,
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[
[
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[
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[
0,
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[
0,
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[
0,
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0
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] | 0
| 0.976946
|
pbe
| true
|
351778855c87064f08ab378609a0952e_123_K1Mg1Pt2Cl1
|
[
"Cl",
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"S",
"Te"
] | 5
|
A2BCD
|
Cl2KSTe
|
K1 Te1 S1 Cl2
| 4
|
[
1,
1,
1
] | 3
|
[
[
5.47954443,
0,
0
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[
0,
5.47954443,
0
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[
0,
0,
5.17471507
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] |
agm001692237
|
[
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0,
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[
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2.587357535
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[
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[
2.739772215,
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[
"K",
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2023-11-16 06:57:59
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[
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[
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[
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| 2.615018
|
pbe
| true
|
b30ab50e5e2b05e5649b1ad603ea2430_123_K1Te1S1Cl2
|
[
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] | 5
|
A2BCD
|
ClMgPtTe2
|
Mg1 Te2 Pt1 Cl1
| 4
|
[
1,
1,
1
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[
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agm001473807
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[
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2023-11-16 06:57:59
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| 4.000259
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pbe
| true
|
18dd1363b95e3f67834e9a0539717268_123_Mg1Te2Pt1Cl1
|
[
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A2BCD
|
ClMgRhSn2
|
Mg1 Sn2 Rh1 Cl1
| 4
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[
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agm001566291
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[
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2023-11-16 06:57:59
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| 4.668335
|
pbe
| true
|
86df68563791bb8a354f2160840f08fa_123_Mg1Sn2Rh1Cl1
|
[
"Cl",
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A2BCD
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ClNaTc2V
|
Na1 V1 Tc2 Cl1
| 4
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[
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[
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agm001510295
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[
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2023-11-16 06:57:59
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[
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| 3.026375
|
pbe
| true
|
17fbfaeb266f8af44f31db614b48a129_123_Na1V1Tc2Cl1
|
[
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A2BCD
|
ClPtSn2Zn
|
Zn1 Sn2 Pt1 Cl1
| 4
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[
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1
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[
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agm001445568
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[
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2023-11-16 06:57:59
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| 2.562842
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pbe
| true
|
36374898a72fe453a1c4e22fbfc97329_123_Zn1Sn2Pt1Cl1
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[
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A2BCD
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CoCr2HNb
|
Nb1 Cr2 Co1 H1
| 4
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[
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1
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[
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agm001637971
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2023-11-16 06:57:59
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pbe
| true
|
ae18789e043395764537cb4cc9b84f4b_123_Nb1Cr2Co1H1
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[
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A8B3C3D
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CoCr3Na3O8
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Na3 Cr3 Co1 O8
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[
1,
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[
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2023-11-16 06:57:59
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pbe
| true
|
b1f00cf7280994f4572bdbaa8850ef92_166_Na3Cr3Co1O8
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[
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A8B3C2D
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Co2Cs3F8Tl
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Cs3 Tl1 Co2 F8
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agm004669604
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2023-11-16 06:57:59
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pbe
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92abd6b6955a8b4cdf311a67a6b51af0_164_Cs3Tl1Co2F8
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[
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A2BCD
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CoCsGa2Hg
|
Cs1 Ga2 Co1 Hg1
| 4
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[
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[
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agm001654148
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2.391844995,
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2.67552912
],
[
0,
0,
0
],
[
0,
0,
2.67552912
],
[
0,
2.391844995,
0
],
[
2.391844995,
0,
0
]
] |
[{"mass": null, "name": "Hg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Hg"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}, {"mass": null, "name": "Cs", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cs"]}]
|
[
"Cs",
"Co",
"Hg",
"Ga",
"Ga"
] |
2023-11-16 06:57:59
|
[
0.2,
0.2,
0.4,
0.2
] |
[
[
2.7731874,
0,
0
],
[
0,
2.7731874,
0
],
[
0,
0,
2.9756773
]
] | -14.575129
|
[
0,
0,
0,
0,
0
] |
[
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | 0.000163
| 1.4645
|
pbe
| true
|
4dd990334f7e4d217c78b766eee82ee2_123_Cs1Ga2Co1Hg1
|
[
"Co",
"Cu",
"Mg",
"Sn"
] | 8
|
A4B2CD
|
CoCu4MgSn2
|
Co1 Cu4 Mg1 Sn2
| 4
|
[
1,
1,
1
] | 3
|
[
[
4.387881,
0,
0
],
[
0,
4.387881,
0
],
[
0,
0,
6.230245
]
] |
oqmd-2376697
|
[
[
2.193939999999999,
2.193939999999999,
0
],
[
2.193939999999999,
0,
1.4949899999999998
],
[
0,
2.193939999999999,
1.4949899999999998
],
[
2.193939999999999,
0,
4.735260000000001
],
[
0,
2.193939999999999,
4.735260000000001
],
[
0,
0,
3.1151199999999997
],
[
0,
0,
0
],
[
2.193939999999999,
2.193939999999999,
3.1151199999999997
]
] |
[{"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Cu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cu"]}, {"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Sn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sn"]}]
|
[
"Co",
"Cu",
"Cu",
"Cu",
"Cu",
"Mg",
"Sn",
"Sn"
] |
2024-11-01 00:00:00
|
[
0.125,
0.5,
0.125,
0.25
] |
[
[
-1.92739,
0,
0
],
[
0,
-1.92739,
0
],
[
0,
0,
-0.45366
]
] | -30.7914
|
[
0.043,
0,
0,
0,
0,
0,
0.001,
0
] |
[
[
0,
0,
0
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[
0,
0,
-0.061519
],
[
0,
0,
-0.061519
],
[
0,
0,
0.061519
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[
0,
0,
0.061519
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | 0.028413
| null |
pbe
| true
|
0de19f4f61335e70c94184afb03c2cda_123_Mg1Co1Cu4Sn2
|
[
"Co",
"Cu",
"H",
"Nb"
] | 5
|
A2BCD
|
Co2CuHNb
|
Nb1 Co2 Cu1 H1
| 4
|
[
1,
1,
1
] | 3
|
[
[
3.82884886,
0,
0
],
[
0,
3.82884886,
0
],
[
0,
0,
3.57243061
]
] |
agm001616382
|
[
[
0,
0,
0
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[
1.91442443,
1.91442443,
1.786215305
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[
0,
1.91442443,
0
],
[
1.91442443,
0,
0
],
[
0,
0,
1.786215305
]
] |
[{"mass": null, "name": "H", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["H"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Cu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cu"]}, {"mass": null, "name": "Nb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nb"]}]
|
[
"H",
"Nb",
"Co",
"Co",
"Cu"
] |
2023-11-16 06:57:59
|
[
0.4,
0.2,
0.2,
0.2
] |
[
[
-2.330901,
0,
0
],
[
0,
-2.330901,
0
],
[
0,
0,
-2.7743387
]
] | -31.422805
|
[
0,
0,
0,
0,
0
] |
[
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | -0
| 4.786369
|
pbe
| true
|
dfd8168ea47201747c96cb8dba8f1057_123_Nb1Co2Cu1H1
|
[
"Co",
"Cu",
"Sm",
"Y"
] | 4
|
ABCD
|
CoCuSmY
|
Sm1 Y1 Co1 Cu1
| 4
|
[
1,
1,
1
] | 3
|
[
[
4.87600541,
0,
0
],
[
2.43800271,
4.22274456,
0
],
[
2.43800271,
1.40758152,
3.98124175
]
] |
agm001316929
|
[
[
7.314008122500001,
4.22274456,
2.9859313125
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[
4.876005415,
2.81516304,
1.990620875
],
[
0,
0,
0
],
[
2.4380027075,
1.40758152,
0.9953104375
]
] |
[{"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Cu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cu"]}, {"mass": null, "name": "Sm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sm"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}]
|
[
"Y",
"Co",
"Cu",
"Sm"
] |
2023-11-16 06:57:59
|
[
0.25,
0.25,
0.25,
0.25
] |
[
[
-2.0946689,
0,
0
],
[
0,
-2.0946689,
0
],
[
0,
0,
-2.0946689
]
] | -22.910696
|
[
-0.072,
0.608,
-0.002,
-0.06
] |
[
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | 0.382682
| 3.502327
|
pbe
| true
|
d859e39d00be4011e42db80b790c258e_216_Sm1Y1Co1Cu1
|
[
"Co",
"Dy",
"Fe",
"Ho"
] | 4
|
ABCD
|
CoDyFeHo
|
Dy1 Ho1 Fe1 Co1
| 4
|
[
1,
1,
1
] | 3
|
[
[
4.73257797,
0,
0
],
[
2.36628899,
4.09853275,
0
],
[
2.36628899,
1.36617758,
3.86413373
]
] |
agm001406285
|
[
[
7.0988669625,
4.0985327475,
2.8981002975
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[
2.3662889875,
1.3661775825000002,
0.9660334325
],
[
4.732577975,
2.7323551650000004,
1.932066865
],
[
0,
0,
0
]
] |
[{"mass": null, "name": "Ho", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ho"]}, {"mass": null, "name": "Fe", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Fe"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Dy", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Dy"]}]
|
[
"Fe",
"Co",
"Ho",
"Dy"
] |
2023-11-16 06:57:59
|
[
0.25,
0.25,
0.25,
0.25
] |
[
[
3.0815885,
0,
0
],
[
0,
3.0815885,
0
],
[
0,
0,
3.0815885
]
] | -24.625288
|
[
1.7,
0.753,
-0.364,
-0.348
] |
[
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | 1.631256
| 6.987735
|
pbe
| true
|
40fd8d4bc73b8d3244873cfcd34283ec_216_Dy1Ho1Fe1Co1
|
[
"Co",
"Dy",
"Sc",
"Zn"
] | 4
|
ABCD
|
CoDyScZn
|
Dy1 Sc1 Zn1 Co1
| 4
|
[
1,
1,
1
] | 3
|
[
[
4.72562547,
0,
0
],
[
2.36281273,
4.09251171,
0
],
[
2.36281273,
1.36417057,
3.85845704
]
] |
agm001368493
|
[
[
2.3628127325,
1.36417057,
0.96461426
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[
4.725625465,
2.72834114,
1.92922852
],
[
0,
0,
0
],
[
7.088438197499999,
4.09251171,
2.89384278
]
] |
[{"mass": null, "name": "Dy", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Dy"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Sc", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sc"]}, {"mass": null, "name": "Zn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zn"]}]
|
[
"Sc",
"Zn",
"Co",
"Dy"
] |
2023-11-16 06:57:59
|
[
0.25,
0.25,
0.25,
0.25
] |
[
[
2.9030511,
0,
0
],
[
0,
2.9030511,
0
],
[
0,
0,
2.9030511
]
] | -20.346975
|
[
0.001,
0,
-0.003,
0.001
] |
[
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | -0.000958
| 2.635218
|
pbe
| true
|
e538fcddff5c2d55c57f9928166528c1_216_Dy1Sc1Zn1Co1
|
[
"Co",
"F",
"Ga",
"Na"
] | 18
|
A6BCD
|
CoF6GaNa
|
Na2 Ga2 Co2 F12
| 4
|
[
1,
1,
1
] | 3
|
[
[
5.29420982,
0,
0
],
[
-2.64710491,
4.5849202,
0
],
[
0,
0,
9.81201799
]
] |
agm005071474
|
[
[
0,
0,
0
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[
0,
0,
4.906008995
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[
2.6471049364710493,
1.5283067180502659,
2.4530044975
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[
-2.6471049164636777e-8,
3.056613481949734,
7.359013492499999
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[
-2.6471049164636777e-8,
3.056613481949734,
2.4530044975
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[
2.6471049364710493,
1.5283067180502659,
7.359013492499999
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[
1.7684448388745717,
2.885887742811262,
1.3973191793370106
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[
4.2621371808812585,
1.610453587043616,
1.3973191793370106
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[
-0.73637222622688,
4.496350453846076,
6.30332817433701
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[
-1.6150322708812588,
2.974466612956384,
8.414698810662989
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[
1.0320725861766429,
1.610453587043616,
3.5086898156629895
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[
3.5257649281833294,
2.885887742811262,
3.5086898156629895
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[
0.7363722791689785,
4.496350453846076,
8.414698810662989
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[
3.3834771362268796,
0.088569746153924,
3.5086898156629895
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[
-0.8786600181833295,
1.699032457188738,
6.30332817433701
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[
1.9107326308310215,
0.088569746153924,
1.3973191793370106
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[
1.615032323823357,
2.974466612956384,
6.30332817433701
],
[
0.8786600711254277,
1.699032457188738,
8.414698810662989
]
] |
[{"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "F", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["F"]}, {"mass": null, "name": "Na", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Na"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Na",
"Na",
"Ga",
"Ga",
"Co",
"Co",
"F",
"F",
"F",
"F",
"F",
"F",
"F",
"F",
"F",
"F",
"F",
"F"
] |
2023-11-16 06:57:59
|
[
0.1111111111111111,
0.6666666666666666,
0.1111111111111111,
0.1111111111111111
] |
[
[
2.5032082,
0,
0
],
[
0,
2.5032082,
0
],
[
0,
0,
3.08988
]
] | -86.948632
|
[
0,
0,
0.001,
0.001,
2.786,
2.786,
0.028,
0.028,
0.028,
0.028,
0.028,
0.028,
0.028,
0.028,
0.028,
0.028,
0.028,
0.028
] |
[
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
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[
0,
0,
0
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[
0.00139393,
0.00118758,
0.00387848
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[
0.00033151,
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0.00387848
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[
-0.00172544,
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0.00387848
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[
-0.00033151,
0.00180097,
-0.00387848
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[
-0.00033151,
-0.00180097,
-0.00387848
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[
-0.00139393,
0.00118758,
-0.00387848
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[
0.00172544,
-0.00061338,
-0.00387848
],
[
0.00172544,
0.00061338,
-0.00387848
],
[
0.00139393,
-0.00118758,
0.00387848
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[
-0.00172544,
0.00061338,
0.00387848
],
[
0.00033151,
0.00180097,
0.00387848
],
[
-0.00139393,
-0.00118758,
-0.00387848
]
] | 5.999998
| 0
|
pbe
| true
|
4529529fabe8801c2ef87381bfdc5795_163_Na2Ga2Co2F12
|
[
"Co",
"Fe",
"Ga",
"S"
] | 5
|
A2BCD
|
Co2FeGaS
|
Ga1 Fe1 Co2 S1
| 4
|
[
1,
1,
1
] | 3
|
[
[
4.276932,
0,
0
],
[
0,
4.276932,
0
],
[
0,
0,
4.53531839
]
] |
agm001426595
|
[
[
0,
0,
2.267659195
],
[
0,
2.138466,
0
],
[
2.138466,
0,
0
],
[
2.138466,
2.138466,
2.267659195
],
[
0,
0,
0
]
] |
[{"mass": null, "name": "S", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["S"]}, {"mass": null, "name": "Fe", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Fe"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"S",
"Co",
"Co",
"Fe",
"Ga"
] |
2023-11-16 06:57:59
|
[
0.4,
0.2,
0.2,
0.2
] |
[
[
76.93566,
0,
0
],
[
0,
76.93566,
0
],
[
0,
0,
54.741245
]
] | -23.158976
|
[
0.043,
1.198,
1.198,
-3.323,
-0.072
] |
[
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | -1.059734
| 9.066333
|
pbe
| true
|
d5437b67d654ab65ebb04afedeb6b3d2_123_Ga1Fe1Co2S1
|
[
"Co",
"Fe",
"H",
"Mo"
] | 5
|
A2BCD
|
CoFe2HMo
|
Fe2 Co1 Mo1 H1
| 4
|
[
1,
1,
1
] | 3
|
[
[
3.66293649,
0,
0
],
[
0,
3.66293649,
0
],
[
0,
0,
3.57607042
]
] |
agm001615909
|
[
[
0,
0,
0
],
[
1.831468245,
1.831468245,
1.78803521
],
[
0,
0,
1.78803521
],
[
0,
1.831468245,
0
],
[
1.831468245,
0,
0
]
] |
[{"mass": null, "name": "Fe", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Fe"]}, {"mass": null, "name": "H", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["H"]}, {"mass": null, "name": "Mo", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mo"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}]
|
[
"H",
"Mo",
"Co",
"Fe",
"Fe"
] |
2023-11-16 06:57:59
|
[
0.2,
0.4,
0.2,
0.2
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[
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[
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[
0,
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] | -38.176187
|
[
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[
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[
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[
0,
0,
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[
0,
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]
] | 0.000053
| 2.779602
|
pbe
| true
|
424021791c2472d86ef18cb168c94599_123_Fe2Co1Mo1H1
|
[
"Co",
"Fe",
"H",
"Re"
] | 5
|
A2BCD
|
CoFe2HRe
|
Fe2 Co1 Re1 H1
| 4
|
[
1,
1,
1
] | 3
|
[
[
3.64757147,
0,
0
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3.64757147,
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[
0,
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3.56148564
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agm001618273
|
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[
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[{"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "H", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["H"]}, {"mass": null, "name": "Fe", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Fe"]}, {"mass": null, "name": "Re", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Re"]}]
|
[
"Re",
"Co",
"Fe",
"Fe",
"H"
] |
2023-11-16 06:57:59
|
[
0.2,
0.4,
0.2,
0.2
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[
[
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0
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[
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9.75576,
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[
0,
0,
9.703811
]
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[
0,
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[
[
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[
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[
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0
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[
0,
0,
0
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[
0,
0,
0
]
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| 4.030448
|
pbe
| true
|
0deaca33367f979a22b006b37afe24bb_123_Fe2Co1Re1H1
|
[
"Co",
"Fe",
"Os",
"Te"
] | 5
|
A2BCD
|
CoFe2OsTe
|
Fe2 Co1 Te1 Os1
| 4
|
[
1,
1,
1
] | 3
|
[
[
4.39144352,
0,
0
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[
0,
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0
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0,
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4.39144352
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agm001589493
|
[
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[
0,
2.26677011,
0
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[
0,
0,
2.19572176
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[
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0,
0
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[{"mass": null, "name": "Fe", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Fe"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Te", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Te"]}, {"mass": null, "name": "Os", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Os"]}]
|
[
"Co",
"Te",
"Os",
"Fe",
"Fe"
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2023-11-16 06:57:59
|
[
0.2,
0.4,
0.2,
0.2
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[
[
3.5532439,
0,
0
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[
0,
6.533886,
0
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[
0,
0,
3.5532439
]
] | -33.026178
|
[
1.161,
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3.287,
2.869
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[
[
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[
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[
0,
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0
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[
0,
0,
0
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[
0,
0,
0
]
] | 8.148099
| 6.1447
|
pbe
| true
|
e0d8eaa5f99e79175abc1dc0b561582c_123_Fe2Co1Te1Os1
|
[
"Co",
"Fe",
"Tb",
"W"
] | 13
|
A6B5CD
|
Co5Fe6TbW
|
Co5 Fe6 Tb1 W1
| 4
|
[
1,
1,
1
] | 3
|
[
[
0,
-4e-8,
4.62611503
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[
-4.2039302,
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2.31305794
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[
-4.2039302,
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mp-1217577
|
[
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[
-5.309694584829221,
0,
0
]
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[{"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Fe", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Fe"]}, {"mass": null, "name": "Tb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tb"]}, {"mass": null, "name": "W", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["W"]}]
|
[
"Tb",
"Fe",
"Fe",
"Fe",
"Fe",
"Fe",
"Fe",
"Co",
"Co",
"Co",
"Co",
"Co",
"W"
] |
2019-01-12 18:53:24
|
[
0.38461538461538464,
0.46153846153846156,
0.07692307692307693,
0.07692307692307693
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[
[
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0,
0
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[
0,
-0.03164184,
-1e-8
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[
0,
-1e-8,
0.92383177
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[
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2.008,
1.422,
1.422,
0.823,
1.007,
1.01,
-0.028
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[
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0
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[
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0
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[
0.03714035,
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0
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[
-0.11463032,
0,
0
]
] | 5.705
| 5.562673
|
pbe
| true
|
0d115dff55d0ffa7cef778ce259c1c39_44_Tb1Fe6Co5W1
|
[
"Co",
"Ga",
"La",
"Mg"
] | 5
|
A2BCD
|
CoGaLaMg2
|
La1 Mg2 Ga1 Co1
| 4
|
[
1,
1,
1
] | 3
|
[
[
4.81390792,
0,
0
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[
0,
4.81390792,
0
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[
0,
0,
4.65554321
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agm001615476
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[
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0
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[
0,
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2.40695396,
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[{"mass": null, "name": "La", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["La"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Mg",
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"Co",
"Ga",
"La"
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2023-11-16 06:57:59
|
[
0.2,
0.2,
0.2,
0.4
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[
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2.1908262,
0,
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[
0,
2.1908262,
0
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[
0,
0,
2.337064
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[
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0.162,
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0.027
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[
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[
0,
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[
0,
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[
0,
0,
0
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| 4.123824
|
pbe
| true
|
3760fcb8efeefbc5e7527708eb8609ec_123_La1Mg2Ga1Co1
|
[
"Co",
"Ga",
"La",
"Zn"
] | 5
|
A2BCD
|
Co2GaLaZn
|
La1 Zn1 Ga1 Co2
| 4
|
[
1,
1,
1
] | 3
|
[
[
4.56074931,
0,
0
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[
0,
5.78368607,
0
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[
0,
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4.56074931
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agm001467600
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[
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0,
0,
2.280374655
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[
2.280374655,
0,
0
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[
0,
2.891843035,
0
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[
0,
0,
0
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[{"mass": null, "name": "La", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["La"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Zn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zn"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Zn",
"Co",
"Co",
"Ga",
"La"
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2023-11-16 06:57:59
|
[
0.4,
0.2,
0.2,
0.2
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[
[
2.9966574,
0,
0
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[
0,
4.0303187,
0
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[
0,
0,
2.9966574
]
] | -16.982739
|
[
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0.086,
0.084,
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[
[
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[
0,
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0
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[
0,
0,
0
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[
0,
0,
0
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] | 0.112501
| 3.204816
|
pbe
| true
|
264445dafbc9817dda4e8305585c6711_123_La1Zn1Ga1Co2
|
[
"Co",
"Ga",
"Na",
"Sn"
] | 5
|
A2BCD
|
CoGaNaSn2
|
Na1 Ga1 Co1 Sn2
| 4
|
[
1,
1,
1
] | 3
|
[
[
4.99051278,
0,
0
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[
0,
4.99051278,
0
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[
0,
0,
4.63732704
]
] |
agm001637575
|
[
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2.31866352
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[
0,
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0
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[
0,
2.49525639,
0
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[
2.49525639,
0,
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[
0,
0,
2.31866352
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] |
[{"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Sn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sn"]}, {"mass": null, "name": "Na", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Na"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Na",
"Co",
"Sn",
"Sn",
"Ga"
] |
2023-11-16 06:57:59
|
[
0.2,
0.2,
0.2,
0.4
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[
[
3.5366979,
0,
0
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[
0,
3.5366979,
0
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[
0,
0,
3.4472704
]
] | -19.580773
|
[
0,
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[
[
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0,
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0
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[
0,
0,
0
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[
0,
0,
0
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| 3.756169
|
pbe
| true
|
89bcd5738eee2224433a32429bb1ba20_123_Na1Ga1Co1Sn2
|
[
"Co",
"Ga",
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"Pr"
] | 8
|
A4B2CD
|
CoGa4Ni2Pr
|
Pr1 Ga4 Co1 Ni2
| 4
|
[
1,
1,
1
] | 3
|
[
[
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0
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[
2.04514969,
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0
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2.04514968,
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agm004800536
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[
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6.078400751485338
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[
2.0451496641130293,
1.1807677081923227,
2.7993387685146627
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[{"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Pr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pr"]}, {"mass": null, "name": "Ni", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ni"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Pr",
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"Co",
"Ni",
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] |
2023-11-16 06:57:59
|
[
0.125,
0.5,
0.25,
0.125
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[
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[
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[
0,
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[
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0.001,
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[
[
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[
0,
0,
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[
0,
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| 5.479604
|
pbe
| true
|
31594accb6869717b6c219cc3ffbf490_166_Pr1Ga4Co1Ni2
|
[
"Co",
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] | 20
|
A5B2C2D
|
Co2Ga5Pm2Rh
|
Pm4 Ga10 Co4 Rh2
| 4
|
[
1,
1,
1
] | 3
|
[
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3.87837119,
0,
0
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[
0,
9.4382746,
0
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[
0,
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agm005141207
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[
0,
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4.7191373
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|
[
"Pm",
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"Ga",
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"Ga",
"Ga",
"Ga",
"Ga",
"Co",
"Co",
"Co",
"Co",
"Rh",
"Rh"
] |
2023-11-16 06:57:59
|
[
0.2,
0.5,
0.2,
0.1
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[
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[
0,
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[
0,
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[
0,
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| 14.727491
|
pbe
| true
|
2372622cb2c7c5877c24612a07d29724_127_Pm4Ga10Co4Rh2
|
[
"Co",
"Ge",
"Hg",
"Th"
] | 10
|
A2BCD
|
CoGeHgTh2
|
Th4 Co2 Hg2 Ge2
| 4
|
[
1,
1,
1
] | 3
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[
[
4.28544912,
0,
0
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7.3120446,
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agm005000793
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5.536296170616498
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[
3.2140868400000002,
2.370809394310098,
1.8966626193835021
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|
[
"Th",
"Th",
"Th",
"Th",
"Co",
"Co",
"Hg",
"Hg",
"Ge",
"Ge"
] |
2023-11-16 06:57:59
|
[
0.2,
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0.4
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[
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0.00032564,
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[
0,
0.00133571,
-0.00314777
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[
0,
-0.00133571,
0.00314777
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| 10.413992
|
pbe
| true
|
ac6b60fba577eddf28dd59f6cf02ace1_11_Th4Co2Hg2Ge2
|
[
"Co",
"Ge",
"Ir",
"Np"
] | 10
|
A4B3C2D
|
CoGe3Ir4Np2
|
Np2 Co1 Ge3 Ir4
| 4
|
[
1,
1,
1
] | 3
|
[
[
4.11258902,
0,
0
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[
0,
4.11258902,
0
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[
0,
0,
10.44636967
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agm004512370
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2.05629451,
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[
2.05629451,
0,
6.630871590672885
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[
0,
2.05629451,
3.8154980793271145
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[{"mass": null, "name": "Ge", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ge"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}, {"mass": null, "name": "Np", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Np"]}]
|
[
"Np",
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"Co",
"Ge",
"Ge",
"Ge",
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"Ir",
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] |
2023-11-16 06:57:59
|
[
0.1,
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0.4,
0.2
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[
[
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2.62913,
0
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[
0,
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2.325348
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|
[
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1.21,
0.003,
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[
0,
0,
0.00314686
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[
0,
0,
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] | 8.573637
| 24.73387
|
pbe
| true
|
229fc6e71ada5e5afa846f1add55b52f_115_Np2Co1Ge3Ir4
|
[
"Co",
"Ge",
"Ir",
"Li"
] | 4
|
ABCD
|
CoGeIrLi
|
Li1 Co1 Ge1 Ir1
| 4
|
[
1,
1,
1
] | 3
|
[
[
4.10077155,
0,
0
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[
0,
4.10077155,
0
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[
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2.90336199
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agm005188223
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[
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2.4999999848063226e-9,
2.0503857775,
1.451680995
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2.050385775,
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0
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[{"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Ge", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ge"]}, {"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}]
|
[
"Li",
"Co",
"Ge",
"Ir"
] |
2023-11-16 06:57:59
|
[
0.25,
0.25,
0.25,
0.25
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[
[
2.9309,
0,
0
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[
0,
2.9309,
0
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[
0,
0,
3.348797
]
] | -23.720378
|
[
0,
0,
0,
0
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[
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0
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[
0,
0,
0
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[
0,
0,
0
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[
0,
0,
0
]
] | 0.000372
| 2.008175
|
pbe
| true
|
f363479d81d560e5711bbe9e3fb9dd47_216_Li1Co1Ge1Ir1
|
[
"Co",
"Ge",
"Mn",
"Ru"
] | 5
|
A2BCD
|
CoGe2MnRu
|
Mn1 Co1 Ge2 Ru1
| 4
|
[
1,
1,
1
] | 3
|
[
[
4.53606275,
0,
0
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[
0,
4.31855375,
0
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[
0,
0,
4.53606275
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agm001496109
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[
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0,
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0
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[
0,
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[
2.268031375,
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2.268031375
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[{"mass": null, "name": "Ge", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ge"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Ru", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ru"]}]
|
[
"Ru",
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"Ge",
"Mn",
"Co"
] |
2023-11-16 06:57:59
|
[
0.2,
0.4,
0.2,
0.2
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[
[
-33.812634,
0,
0
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[
0,
44.969368,
0
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[
0,
0,
-33.812634
]
] | -29.698487
|
[
0.05,
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1.788
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[
[
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0
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[
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[
0,
0,
0
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[
0,
0,
0
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[
0,
0,
0
]
] | 1.365786
| 5.284347
|
pbe
| true
|
51edcb10408a1387a5c25b0d723ca714_123_Mn1Co1Ge2Ru1
|
[
"Co",
"Ge",
"Rh",
"Tm"
] | 5
|
A2BCD
|
CoGe2RhTm
|
Tm1 Co1 Ge2 Rh1
| 4
|
[
1,
1,
1
] | 3
|
[
[
4.02687526,
0,
0
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[
0,
4.02687526,
0
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[
-2.01343763,
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5.11958468
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agm005017147
|
[
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0
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2.0134376299999994,
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2.55979234
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[
2.0134376501343763,
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1.2542982977958468
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[
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3.865286382204153
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[
0,
2.0134376299999994,
2.55979234
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] |
[{"mass": null, "name": "Ge", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ge"]}, {"mass": null, "name": "Rh", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rh"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Tm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tm"]}]
|
[
"Tm",
"Co",
"Ge",
"Ge",
"Rh"
] |
2023-11-16 06:57:59
|
[
0.2,
0.4,
0.2,
0.2
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[
[
5.670934,
0,
0
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[
0,
5.670934,
0
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[
0,
0,
6.0870757
]
] | -31.702785
|
[
0,
0,
0,
0,
0
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[
[
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0
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[
0,
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0
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[
0,
0,
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[
0,
0,
0.00027393
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[
0,
0,
0
]
] | 0.000002
| 2.285428
|
pbe
| true
|
b4ceee639b795611da4b0c9d73e62800_119_Tm1Co1Ge2Rh1
|
[
"Co",
"H",
"V",
"W"
] | 5
|
A2BCD
|
CoHV2W
|
V2 Co1 H1 W1
| 4
|
[
1,
1,
1
] | 3
|
[
[
4.12002015,
0,
0
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[
0,
4.12002015,
0
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[
0,
0,
3.25537157
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] |
agm001641481
|
[
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0,
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0,
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1.627685785
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2.060010075,
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1.627685785
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[
0,
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0
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[
2.060010075,
0,
0
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] |
[{"mass": null, "name": "H", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["H"]}, {"mass": null, "name": "W", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["W"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "V", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["V"]}]
|
[
"H",
"Co",
"W",
"V",
"V"
] |
2023-11-16 06:57:59
|
[
0.2,
0.2,
0.4,
0.2
] |
[
[
6.131761,
0,
0
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[
0,
6.131761,
0
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[
0,
0,
5.0422645
]
] | -41.945865
|
[
0,
0.001,
0,
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0
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[
[
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0
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[
0,
0,
0
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[
0,
0,
0
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[
0,
0,
0
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[
0,
0,
0
]
] | 0.000661
| 4.62977
|
pbe
| true
|
b5786478d31009ed0b05016d486ef532_123_V2Co1H1W1
|
[
"Co",
"Hf",
"Sr",
"W"
] | 5
|
A2BCD
|
CoHfSr2W
|
Sr2 Hf1 Co1 W1
| 4
|
[
1,
1,
1
] | 3
|
[
[
5.88811467,
0,
0
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[
0,
4.38149433,
0
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[
0,
0,
5.88811467
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] |
agm001482265
|
[
[
0,
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2.944057335
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[
2.944057335,
0,
0
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[
2.944057335,
2.190747165,
2.944057335
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[
0,
0,
0
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[
0,
2.190747165,
0
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] |
[{"mass": null, "name": "Hf", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Hf"]}, {"mass": null, "name": "W", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["W"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Sr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sr"]}]
|
[
"Sr",
"Sr",
"Hf",
"W",
"Co"
] |
2023-11-16 06:57:59
|
[
0.2,
0.2,
0.4,
0.2
] |
[
[
-0.40236962,
0,
0
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[
0,
2.6640015,
0
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[
0,
0,
-0.40236962
]
] | -25.43082
|
[
-0.014,
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0.272,
0.537
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[
[
0,
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0
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[
0,
0,
0
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[
0,
0,
0
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[
0,
0,
0
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[
0,
0,
0
]
] | 0.007813
| 8.268317
|
pbe
| true
|
0dacc965509cbdb0daa5c211c17bdf75_123_Sr2Hf1Co1W1
|
[
"Co",
"Hg",
"Nb",
"S"
] | 11
|
A6B2C2D
|
CoHg2Nb2S6
|
Nb2 Co1 Hg2 S6
| 4
|
[
1,
1,
1
] | 3
|
[
[
5.87235592,
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-0.20884099
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[
-3.02323078,
5.03626272,
-0.20884099
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[
-1.37462411,
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9.37561101
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] |
agm004586892
|
[
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2.037962337473326,
4.478964515
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[
2.0620164239314653,
0.4965411125266739,
4.478964515
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[
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4.687805505
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[
0.25848425879969056,
3.7414555670698557,
2.9401377210288935
]
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[{"mass": null, "name": "Hg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Hg"]}, {"mass": null, "name": "Nb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nb"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "S", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["S"]}]
|
[
"Nb",
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"Hg",
"Hg",
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"S",
"S",
"S",
"S",
"S"
] |
2023-11-16 06:57:59
|
[
0.09090909090909091,
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0.18181818181818182,
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[
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[
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| 4.281347
|
pbe
| true
|
d15dd09603e93019ee3f0e3c656882bc_12_Nb2Co1Hg2S6
|
[
"Co",
"I",
"Pd",
"Rb"
] | 5
|
A2BCD
|
CoI2PdRb
|
Rb1 Co1 Pd1 I2
| 4
|
[
1,
1,
1
] | 3
|
[
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agm001459898
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[{"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "I", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["I"]}, {"mass": null, "name": "Pd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pd"]}]
|
[
"I",
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"Rb",
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2023-11-16 06:57:59
|
[
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0.2
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[
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[
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0.128
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[
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[
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[
0,
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[
0,
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| 6.539698
|
pbe
| true
|
815a3b79c5552f59c2132300d6db414d_123_Rb1Co1Pd1I2
|
[
"Co",
"K",
"Li",
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] | 5
|
A2BCD
|
CoKLiSe2
|
K1 Li1 Co1 Se2
| 4
|
[
1,
1,
1
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[
[
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agm001419754
|
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[{"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Se", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Se"]}, {"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}]
|
[
"K",
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2023-11-16 06:57:59
|
[
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[
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[
0.001,
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[
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[
0,
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0,
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0
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| 7.066867
|
pbe
| true
|
eab806ae170928aa4a78fda270b5e193_123_K1Li1Co1Se2
|
[
"Co",
"K",
"Np",
"S"
] | 11
|
A6B2C2D
|
CoK2Np2S6
|
K2 Np2 Co1 S6
| 4
|
[
1,
1,
1
] | 3
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[
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agm004587026
|
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2.4360579876063078
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[{"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "S", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["S"]}, {"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}, {"mass": null, "name": "Np", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Np"]}]
|
[
"K",
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"Co",
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"S",
"S",
"S",
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2023-11-16 06:57:59
|
[
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[
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[
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| 14.798728
|
pbe
| true
|
df76399acb7761600ffa37edbc7dfffd_12_K2Np2Co1S6
|
[
"Co",
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"N",
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] | 5
|
A2BCD
|
CoLaN2Se
|
La1 Co1 Se1 N2
| 4
|
[
1,
1,
1
] | 3
|
[
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0,
0
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[
0,
4.08390443,
0
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[
0,
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agm001733536
|
[
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[
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0,
0,
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[{"mass": null, "name": "La", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["La"]}, {"mass": null, "name": "Se", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Se"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "N", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["N"]}]
|
[
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2023-11-16 06:57:59
|
[
0.2,
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0.2
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[
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[
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[
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[
0,
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[
0,
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0
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| 7.548751
|
pbe
| true
|
5116af5d1032e474079f50493fe1a030_123_La1Co1Se1N2
|
[
"Co",
"Li",
"Mg",
"Sn"
] | 4
|
ABCD
|
CoLiMgSn
|
Co1 Li1 Mg1 Sn1
| 4
|
[
1,
1,
1
] | 3
|
[
[
0,
3.13224,
3.13224
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[
3.13224,
0,
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[
3.13224,
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0
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oqmd-2178245
|
[
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1.56612
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[
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4.69836
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[
3.13224,
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[
0,
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[{"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Sn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sn"]}]
|
[
"Co",
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"Mg",
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2024-11-01 00:00:00
|
[
0.25,
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0.25,
0.25
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[
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0,
0
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[
0,
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[
0,
0,
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] | -15.3488
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[
0.001,
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[
[
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[
0,
0,
0
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[
0,
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0
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[
0,
0,
0
]
] | 0.001116
| null |
pbe
| true
|
6af16633fd8b0b51d79d5706b2a8ac09_216_Li1Mg1Co1Sn1
|
[
"Co",
"Li",
"Mn",
"O"
] | 16
|
A8B4C3D
|
Co3Li4MnO8
|
Li4 Mn1 Co3 O8
| 4
|
[
1,
1,
1
] | 3
|
[
[
5.06321402,
0.12072253,
0.05370009
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[
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[
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agm003218868
|
[
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[
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[{"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
|
[
"Li",
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"Co",
"Co",
"Co",
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] |
2023-11-16 06:57:59
|
[
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0.5
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[
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0.00326028
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[
0.00085235,
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] | 10.000001
| -0.042645
|
pbe
| true
|
331ba6102025e3e8ed0b6635fd99a45c_2_Li4Mn1Co3O8
|
[
"Co",
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"Mn",
"O"
] | 20
|
A5B3CD
|
CoLi3MnO5
|
Li6 Mn2 Co2 O10
| 4
|
[
1,
1,
1
] | 3
|
[
[
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agm003225296
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[{"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
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2023-11-16 06:57:59
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