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[
"Eu",
"Pa",
"Re"
] | 6
|
A4BC
|
EuPaRe4
|
Eu1 Pa1 Re4
| 3
|
[
1,
1,
1
] | 3
|
[
[
5.44913182,
0,
0
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[
2.72456591,
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0
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agm001174658
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|
[
"Eu",
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2023-11-16 06:57:59
|
[
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0.6666666666666666
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] | -69.029694
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[
6.56,
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[
-0.00164415,
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[
0,
0,
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| 10.352002
|
pbe
| true
|
1178272d720e0a99d36e1e7c42795383_216_Eu1Pa1Re4
|
[
"Eu",
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"Sm"
] | 4
|
A2BC
|
Eu2PdSm
|
Sm1 Eu2 Pd1
| 3
|
[
1,
1,
1
] | 3
|
[
[
3.65312171,
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0
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[
0,
3.65312171,
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agm001149078
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4.588419875
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|
[
"Eu",
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2023-11-16 06:57:59
|
[
0.5,
0.25,
0.25
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0
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0,
3.9087067,
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0,
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[
6.847,
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0.04
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0,
0,
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[
0,
0,
0
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[
0,
0,
0
]
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| 16.778505
|
pbe
| true
|
198d631864a69427b56e04ce3c26933b_123_Sm1Eu2Pd1
|
[
"Eu",
"Pm",
"Pr"
] | 4
|
A2BC
|
Eu2PmPr
|
Pr1 Pm1 Eu2
| 3
|
[
1,
1,
1
] | 3
|
[
[
5.4022906,
0,
0
],
[
0,
5.2689371,
0
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[
0,
0,
5.2689371
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agm001246158
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0,
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0,
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0
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[
2.7011453,
2.63446855,
2.63446855
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[
2.7011453,
0,
0
]
] |
[{"mass": null, "name": "Pr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pr"]}, {"mass": null, "name": "Pm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pm"]}, {"mass": null, "name": "Eu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Eu"]}]
|
[
"Eu",
"Eu",
"Pr",
"Pm"
] |
2023-11-16 06:57:59
|
[
0.5,
0.25,
0.25
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1.3301581,
0,
0
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0,
1.814564,
0
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[
0,
0,
1.814564
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[
-6.894,
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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
]
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| 5.221757
|
pbe
| true
|
af7b43fa4689291f1cdf502e172fe4e3_123_Pr1Pm1Eu2
|
[
"Eu",
"Rh",
"Ti"
] | 4
|
A2BC
|
EuRh2Ti
|
Eu1 Ti1 Rh2
| 3
|
[
1,
1,
1
] | 3
|
[
[
4.19439369,
0,
0
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[
2.09719685,
3.63245149,
0
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[
2.09719685,
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5.35083609
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agm001928119
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3.632450288437384,
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[
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0
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|
[
"Eu",
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"Ti"
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2023-11-16 06:57:59
|
[
0.25,
0.5,
0.25
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0
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[
0,
7.340655,
0
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[
0,
0,
6.9810967
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[
6.717,
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0.056
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[
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[
0,
0,
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0,
0,
0
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| 10.95036
|
pbe
| true
|
abfe59a81bcd0efd05e82f060cfa82a0_166_Eu1Ti1Rh2
|
[
"Eu",
"Sb",
"Tm"
] | 6
|
ABC
|
EuSbTm
|
Eu2 Tm2 Sb2
| 3
|
[
1,
1,
1
] | 3
|
[
[
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0.00019972
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0.00063146
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[
-2.34242706,
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8.4599307
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agm002313475
|
[
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2.34161831,
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0.00009986
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0.00031573
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[{"mass": null, "name": "Sb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sb"]}, {"mass": null, "name": "Tm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tm"]}, {"mass": null, "name": "Eu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Eu"]}]
|
[
"Eu",
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"Tm",
"Tm"
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2023-11-16 06:57:59
|
[
0.3333333333333333,
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0.3333333333333333
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[
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1.8408571,
0.00811603
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[
0.01736776,
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1.8413006
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|
[
6.937,
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0.391
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[
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0.02042924
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0.00075348,
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[
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0.01073283
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[
0,
0,
0
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[
0,
0,
0
]
] | 15.676143
| 4.909794
|
pbe
| true
|
f6c5f33a2af0839d90d85b933062c907_139_Eu2Tm2Sb2
|
[
"Eu",
"Tm",
"Zn"
] | 4
|
A2BC
|
EuTmZn2
|
Eu1 Tm1 Zn2
| 3
|
[
1,
1,
1
] | 3
|
[
[
3.5970402,
0,
0
],
[
0,
5.1397325,
0
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[
0,
0,
5.1397325
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] |
agm001231793
|
[
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2.56986625
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[
0,
0,
2.56986625
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[
0,
2.56986625,
0
],
[
1.7985201,
0,
0
]
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[{"mass": null, "name": "Tm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tm"]}, {"mass": null, "name": "Zn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zn"]}, {"mass": null, "name": "Eu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Eu"]}]
|
[
"Eu",
"Zn",
"Zn",
"Tm"
] |
2023-11-16 06:57:59
|
[
0.25,
0.25,
0.5
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[
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[
0,
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2.1442585
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[
6.857,
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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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| 2.317186
|
pbe
| true
|
290c38119e843a4d1370251d74bf9ab3_123_Eu1Tm1Zn2
|
[
"F",
"Fe",
"O"
] | 24
|
A7B4C
|
F7Fe4O
|
F14 Fe8 O2
| 3
|
[
1,
1,
1
] | 3
|
[
[
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mp-756404
|
[
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[{"mass": null, "name": "F", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["F"]}, {"mass": null, "name": "Fe", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Fe"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}]
|
[
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2019-10-23 23:49:15
|
[
0.5833333333333334,
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0.04948299,
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[
0.01929672,
0.02727524,
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] | 32.883
| 1.666535
|
pbe
| true
|
e0dcb35e4301696cde720dc69466e997_1_Fe8O2F14
|
[
"F",
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] | 12
|
A4BC
|
F4FeLi
|
Li2 Fe2 F8
| 3
|
[
1,
1,
1
] | 3
|
[
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5.28238972,
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0
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[
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0
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[
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agm005255685
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2023-11-16 06:57:59
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b3892b718be81c14ccb6724e05346d26_63_Li2Fe2F8
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A8B2C
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F8GaHg2
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Ga1 Hg2 F8
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2023-11-16 06:57:59
|
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| true
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a40620548d171583b4a62717829ae977_12_Ga1Hg2F8
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[
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A6BC
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F6GeTb
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Tb1 Ge1 F6
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2023-11-16 06:57:59
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| true
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c77deda9f17e0b991f56ca475f3a1094_166_Tb1Ge1F6
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[
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A2BC
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F2HO
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H2 O2 F4
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2023-11-16 06:57:59
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980ed76cbccaf50c12aaab592409278f_1_H2O2F4
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[
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A6BC
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F6HSr
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Sr1 H1 F6
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agm005814725
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2023-11-16 06:57:59
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48cebd6d7f1a1aaa16acba6d0ef1947a_2_Sr1H1F6
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A11B2C
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F11Hf2Ho
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Ho2 Hf4 F22
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2023-11-16 06:57:59
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pbe
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ad66731012a0a2e2db88b49055a7981c_72_Ho2Hf4F22
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[
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A3BC
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FIrSn3
|
Sn3 Ir1 F1
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[
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agm002473210
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2023-11-16 06:57:59
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pbe
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2fb6b2bfd960678d733a9ebb71538f7a_221_Sn3Ir1F1
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[
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A8B2C
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F8KTe2
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K1 Te2 F8
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agm006031795
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2023-11-16 06:57:59
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pbe
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40ab587557a071d75a43760308ea3a28_2_K1Te2F8
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A10B3C
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F10KY3
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K2 Y6 F20
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2023-11-16 06:57:59
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05eff97e60103315aca1d4a83a95c10c_225_K2Y6F20
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A7BC
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F7LuPt
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2023-11-16 06:57:59
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|
pbe
| true
|
b2575121b380d71fe1b91dcd3e836ae3_14_Lu4Pt4F28
|
[
"F",
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|
A10B4C3
|
F10Mg3Tl4
|
Mg3 Tl4 F10
| 3
|
[
1,
1,
1
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|
[
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agm005585063
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2023-11-16 06:57:59
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[
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pbe
| true
|
238e9c157da9609593601e9a1a4d665d_139_Mg3Tl4F10
|
[
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A4B3C2
|
F2Mn3O4
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Mn6 O8 F4
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agm005252076
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2023-11-16 06:57:59
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pbe
| true
|
4580aaa6d30ec26493451c3ec30402f9_2_Mn6O8F4
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[
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|
A2B2C
|
FO2Sr2
|
Sr2 O2 F1
| 3
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agm002938177
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|
[
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2023-11-16 06:57:59
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pbe
| true
|
9ebb6a39980647f4e613eff0a0d96777_139_Sr2O2F1
|
[
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A5B4C3
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F5O3V4
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V4 O3 F5
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[
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[
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agm003210057
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|
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"V",
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2023-11-16 06:57:59
|
[
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[
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pbe
| true
|
5f935f39992418716d90e02dcb0190aa_44_V4O3F5
|
[
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|
A3B2C
|
FO2Zn3
|
Zn3 O2 F1
| 3
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[
1,
1,
1
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[
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agm003424403
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|
[
"Zn",
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2023-11-16 06:57:59
|
[
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0.5
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[
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[
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|
pbe
| true
|
4074957bda52bc75bf88bb0a7055d4df_44_Zn3O2F1
|
[
"F",
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|
A2BC
|
FOs2Sn
|
Sn1 Os2 F1
| 3
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[
1,
1,
1
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|
[
[
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2024-11-01 00:00:00
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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pbe
| true
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45b126c8f5ba5ccba65c4e202b84f831_127_Fe4Tc2Ge4
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A7B2C2
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Fe2Hg2I7
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Fe2 Hg2 I7
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2023-11-16 06:57:59
|
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pbe
| true
|
e1ecf0fdd06e03eab17733954a698b04_12_Fe2Hg2I7
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[
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A2BC
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Fe2HgP
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Fe2 Hg1 P1
| 3
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agm004192709
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2023-11-16 06:57:59
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pbe
| true
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d64effeae01f12cf27f5bbf8d6a72ac3_6_Fe2Hg1P1
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[
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ABC
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FeISb
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Fe2 Sb2 I2
| 3
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agm001056457
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2023-11-16 06:57:59
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pbe
| true
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c38c05d9d6fb609c0ab6c06b03da189d_2_Fe2Sb2I2
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A3B2C
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Fe3Mg2Pt
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2023-11-16 06:57:59
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pbe
| true
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2145d7c28cdf45f09697c8c9346c6a6c_194_Mg4Fe6Pt2
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[
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A2BC
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FeMnOs2
|
Mn1 Fe1 Os2
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agm004159408
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2023-11-16 06:57:59
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| true
|
ccd6562370f820a2e2848d1a23f2aa84_160_Mn1Fe1Os2
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A5B3C2
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Ga3Pt5Th2
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2023-11-16 06:57:59
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A3B2C
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FeNi3V2
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2023-11-16 06:57:59
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FeO4Rb3
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Rb3 Fe1 O4
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2023-11-16 06:57:59
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A8B3C2
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Fe3O8Si2
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2023-11-16 06:57:59
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|
e062858744d202474f262c6aad908345_1_Fe9Si6O24
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A2BC
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Fe1 Re2 Os1
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2023-11-16 06:57:59
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|
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ABC
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Fe1 Os1 Se1
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2023-11-16 06:57:59
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[
1.5,
0.68,
0.005
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[
[
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[
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[
0,
0,
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] | 2.275634
| 4.094043
|
pbe
| true
|
a90854b935f838899960f9f4794a958b_216_Fe1Os1Se1
|
[
"Fe",
"Pd",
"V"
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|
A5B4C
|
Fe4Pd5V
|
V1 Fe4 Pd5
| 3
|
[
1,
1,
1
] | 3
|
[
[
2.7087884,
0,
0
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[
0,
2.7087884,
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[
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18.98824651
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agm006121308
|
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|
[
"V",
"Fe",
"Fe",
"Fe",
"Fe",
"Pd",
"Pd",
"Pd",
"Pd",
"Pd"
] |
2023-11-16 06:57:59
|
[
0.4,
0.5,
0.1
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[
[
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10.20635,
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[
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10.17193
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0.19,
0.35,
0.342,
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0.19
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0,
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| 8.178922
|
pbe
| true
|
dca28d4649c892c282105dfe4bdc628b_123_V1Fe4Pd5
|
[
"Fe",
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] | 4
|
A2BC
|
Fe2ReRh
|
Fe2 Re1 Rh1
| 3
|
[
1,
1,
1
] | 3
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[
[
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0.00524492,
-0.02563223
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0.77483869,
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4.46984551
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agm004265978
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[
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2.3090004838400837,
0.7028534087117175,
1.1010612816982506
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[{"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"]}, {"mass": null, "name": "Rh", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rh"]}]
|
[
"Fe",
"Fe",
"Re",
"Rh"
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2023-11-16 06:57:59
|
[
0.5,
0.25,
0.25
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[
[
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0.19916555
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10.423756,
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[
0.19916481,
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10.066939
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[
2.163,
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0.155
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[
[
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-0.00707804
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[
0.00248366,
0.00075602,
0.00351332
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| 4.724271
|
pbe
| true
|
7db0eadb0c4ddb0280f9ddad6f42f1fe_8_Fe2Re1Rh1
|
[
"Fe",
"Rh",
"Sr"
] | 8
|
A2BC
|
Fe2RhSr
|
Sr2 Fe4 Rh2
| 3
|
[
1,
1,
1
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[
[
3.93693043,
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0
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[
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[
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agm002271932
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[
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6.161883338816151
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[
1.9667534455266769,
2.9454281710245604,
0.5422682511838497
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[{"mass": null, "name": "Fe", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Fe"]}, {"mass": null, "name": "Rh", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rh"]}, {"mass": null, "name": "Sr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sr"]}]
|
[
"Sr",
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"Fe",
"Fe"
] |
2023-11-16 06:57:59
|
[
0.5,
0.25,
0.25
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[
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0
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[
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[
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0.921,
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[
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[
0.0021224,
-0.01451586,
0.0070501
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| 10.446837
|
pbe
| true
|
b8638ea97d841c41b161539b0224d057_63_Sr2Fe4Rh2
|
[
"Fe",
"Si",
"Zr"
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|
A3B2C
|
FeSi3Zr2
|
Zr4 Fe2 Si6
| 3
|
[
1,
1,
1
] | 3
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[
[
5.13365399,
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agm005511688
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[
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[
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[{"mass": null, "name": "Zr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zr"]}, {"mass": null, "name": "Fe", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Fe"]}, {"mass": null, "name": "Si", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Si"]}]
|
[
"Si",
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"Fe",
"Zr",
"Zr",
"Zr",
"Zr"
] |
2023-11-16 06:57:59
|
[
0.16666666666666666,
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0.3333333333333333
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[
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[
0,
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0.014,
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0.001,
0.001
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[
0,
0,
-0.00166443
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[
0,
0,
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] | 0.030363
| 8.968194
|
pbe
| true
|
2cf0ecbedd80306ddfe4e638c41861e5_194_Zr4Fe2Si6
|
[
"Fe",
"W",
"Y"
] | 4
|
A2BC
|
FeW2Y
|
Y1 Fe1 W2
| 3
|
[
1,
1,
1
] | 3
|
[
[
4.84862467,
0,
0
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[
0,
2.84198938,
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[
0,
0.90590219,
5.04182623
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agm004207142
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[
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4.980042781666667
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1.9883895930543813,
2.535817948333333
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[
2.424312335,
0.9369728924999999,
1.252643455
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[{"mass": null, "name": "Fe", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Fe"]}, {"mass": null, "name": "W", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["W"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}]
|
[
"Fe",
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"W",
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2023-11-16 06:57:59
|
[
0.25,
0.5,
0.25
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[
[
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0
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[
0,
2.1679082,
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[
0,
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2.6600647
]
] | -38.561041
|
[
2.043,
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[
[
0,
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[
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[
0,
0.00333151,
0.00018487
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[
0,
0,
0
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| 4.272038
|
pbe
| true
|
a309c0a929225c5f2e3b4cb27e7b5387_10_Y1Fe1W2
|
[
"Ga",
"Gd",
"Mg"
] | 5
|
A2B2C
|
Ga2GdMg2
|
Gd1 Mg2 Ga2
| 3
|
[
1,
1,
1
] | 3
|
[
[
4.29973536,
0,
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[
0,
4.29973536,
0
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[
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agm002343388
|
[
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1.221054791395293
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[
8.593517551266813e-17,
8.593517551266813e-17,
4.665821358604707
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[{"mass": null, "name": "Gd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Gd"]}, {"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",
"Mg",
"Gd",
"Ga",
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2023-11-16 06:57:59
|
[
0.4,
0.2,
0.4
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[
[
1.9438401,
0,
0
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[
0,
1.9438401,
0
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[
0,
0,
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] | -25.305139
|
[
-0.003,
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[
[
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[
0,
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0
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[
0,
0,
0.00129695
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[
0,
0,
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] | 7.227129
| 2.039348
|
pbe
| true
|
77b40be4d31723efb332942ec2ed4218_139_Gd1Mg2Ga2
|
[
"Ga",
"Gd",
"Pm"
] | 4
|
A2BC
|
GaGdPm2
|
Pm2 Gd1 Ga1
| 3
|
[
1,
1,
1
] | 3
|
[
[
3.60360844,
0,
0
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[
0,
3.60360844,
0
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[
0,
0,
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agm001137984
|
[
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1.80180422,
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0
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[
0,
0,
7.139613759842457
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[
0,
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[{"mass": null, "name": "Gd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Gd"]}, {"mass": null, "name": "Pm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pm"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Gd",
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"Pm"
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2023-11-16 06:57:59
|
[
0.25,
0.25,
0.5
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[
[
1.2076023,
0,
0
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[
0,
1.2076023,
0
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[
0,
0,
1.1909208
]
] | -27.590681
|
[
7.204,
0.005,
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[
[
0,
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[
0,
0,
0
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[
0,
0,
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[
0,
0,
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] | 7.535566
| 5.166234
|
pbe
| true
|
96f5570b8a501b0cd8b1572cf4afda51_123_Pm2Gd1Ga1
|
[
"Ga",
"Hf",
"Mn"
] | 13
|
A6B6C
|
Ga6HfMn6
|
Hf1 Mn6 Ga6
| 3
|
[
1,
1,
1
] | 3
|
[
[
4.68337825,
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2.29345766,
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agm006097637
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1.9380143800460046
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[
5.148446238868448,
4.936617972665491,
7.502997279953995
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] |
[{"mass": null, "name": "Hf", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Hf"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Hf",
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] |
2023-11-16 06:57:59
|
[
0.46153846153846156,
0.07692307692307693,
0.46153846153846156
] |
[
[
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[
0.038295,
7.192756,
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[
-0.04307939,
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] | -85.509984
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| 13.081318
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pbe
| true
|
0ed18439c28ce06daaa079b10d86fc87_71_Hf1Mn6Ga6
|
[
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ABC
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GaHgPu
|
Ga1 Hg1 Pu1
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1
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[
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oqmd-7004183
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[
"Ga",
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2024-11-01 00:00:00
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[
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pbe
| true
|
ead8ef355af0b050678448075b20307f_216_Pu1Ga1Hg1
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[
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A5B2C2
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Ga2Hg2Tm5
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Tm10 Ga4 Hg4
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[
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agm003316144
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2023-11-16 06:57:59
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pbe
| true
|
6c628a9b3e3168226e0f0f2f493a9ccc_64_Tm10Ga4Hg4
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[
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A2BC
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Ga2HgV
|
V1 Ga2 Hg1
| 3
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[
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[
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agm002748459
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[
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2023-11-16 06:57:59
|
[
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| 2.657458
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pbe
| true
|
854a171df5761bf3f875c731631e5949_225_V1Ga2Hg1
|
[
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A6B5C3
|
Ga6Ho3Ni5
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Ho6 Ga12 Ni10
| 3
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agm005708269
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2023-11-16 06:57:59
|
[
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|
pbe
| true
|
431f087415a96669cb3adbe5e0dbdc91_59_Ho6Ga12Ni10
|
[
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|
A2BC
|
GaHo2Sn
|
Ho2 Ga1 Sn1
| 3
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[
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[
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agm001206685
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|
[
"Ho",
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2023-11-16 06:57:59
|
[
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| 2.558454
|
pbe
| true
|
5cf61cb0985aca1e38ddd51aa8b57735_123_Ho2Ga1Sn1
|
[
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|
A8B2C
|
GaIr2La8
|
La8 Ga1 Ir2
| 3
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[
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1
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[
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agm006020466
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|
[
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2023-11-16 06:57:59
|
[
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[
0.00117659,
0.00280986,
-0.00404885
],
[
0.00253427,
-0.00231814,
0.00372512
]
] | -0.000166
| 14.398006
|
pbe
| true
|
31bd4ca0cbc7cf97c0981758c3f4aac7_8_La8Ga1Ir2
|
[
"Ga",
"Ir",
"Ti"
] | 6
|
A3B2C
|
Ga3IrTi2
|
Ti2 Ga3 Ir1
| 3
|
[
1,
1,
1
] | 3
|
[
[
4.41459069,
0,
0
],
[
0,
5.28067121,
0
],
[
-2.20729535,
-2.6403356,
4.32315099
]
] |
agm003431062
|
[
[
2.2072975505742645,
-0.0000026386145246211223,
1.4880979140998798
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[
-0.0000022105742648490488,
2.6403382486145253,
2.8350530759001207
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[
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3.433952679741773e-9,
2.969098943534575
],
[
0,
0,
0
],
[
2.207295343433952,
2.640335606566048,
1.3540520464654249
],
[
0,
2.640335605,
0
]
] |
[{"mass": null, "name": "Ir", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ir"]}, {"mass": null, "name": "Ti", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ti"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Ti",
"Ti",
"Ga",
"Ga",
"Ga",
"Ir"
] |
2023-11-16 06:57:59
|
[
0.5,
0.16666666666666666,
0.3333333333333333
] |
[
[
3.5758882,
0,
0
],
[
0,
3.4839065,
0
],
[
0,
0,
3.4288893
]
] | -34.458413
|
[
0,
0,
0,
0,
0,
0
] |
[
[
0,
0,
0.0047025
],
[
0,
0,
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[
0,
0,
0.00187499
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[
0,
0,
0
],
[
0,
0,
-0.00187499
],
[
0,
0,
0
]
] | 0.000001
| 5.247873
|
pbe
| true
|
534da169c4493ae50fb78f30aa3c421b_71_Ti2Ga3Ir1
|
[
"Ga",
"La",
"Na"
] | 5
|
A3BC
|
GaLa3Na
|
Na1 La3 Ga1
| 3
|
[
1,
1,
1
] | 3
|
[
[
5.89604347,
0,
0
],
[
0,
5.89604347,
0
],
[
0,
0,
5.89604347
]
] |
agm002549884
|
[
[
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2.948021735,
2.948021735
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[
0,
0,
0
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[
0,
2.948021735,
0
],
[
0,
0,
2.948021735
],
[
2.948021735,
0,
0
]
] |
[{"mass": null, "name": "La", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["La"]}, {"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",
"Ga",
"La",
"La",
"La"
] |
2023-11-16 06:57:59
|
[
0.2,
0.6,
0.2
] |
[
[
1.1504331,
0,
0
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[
0,
1.1504331,
0
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[
0,
0,
1.1504331
]
] | -18.608388
|
[
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,
0,
0
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[
0,
0,
0
]
] | 0.001976
| 10.175097
|
pbe
| true
|
2d4930bfde354bf70d41b9b898a55850_221_Na1La3Ga1
|
[
"Ga",
"Li",
"Pm"
] | 5
|
A2B2C
|
GaLi2Pm2
|
Li2 Pm2 Ga1
| 3
|
[
1,
1,
1
] | 3
|
[
[
3.58504386,
0,
0
],
[
0,
3.58504386,
0
],
[
-1.79252193,
-1.79252193,
9.7948167
]
] |
agm003406358
|
[
[
1.7925219300000002,
0,
4.89740835
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[
0,
1.7925219300000002,
4.89740835
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[
1.0095212740023385e-16,
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7.926023463058531
],
[
1.7925219299999997,
1.7925219658504388,
1.86879323694147
],
[
0,
0,
0
]
] |
[{"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Pm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pm"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Li",
"Li",
"Pm",
"Pm",
"Ga"
] |
2023-11-16 06:57:59
|
[
0.2,
0.4,
0.4
] |
[
[
0.63291466,
0,
0
],
[
0,
0.63291466,
0
],
[
0,
0,
0.70038486
]
] | -16.822155
|
[
0,
0,
0,
0,
0
] |
[
[
0,
0,
0
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[
0,
0,
0
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[
0,
0,
0.000092
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[
0,
0,
-0.000092
],
[
0,
0,
0
]
] | 0.001473
| 5.061283
|
pbe
| true
|
274cd79bd5a578d4498c1d52188ec385_139_Li2Pm2Ga1
|
[
"Ga",
"Li",
"Si"
] | 7
|
A4B2C
|
Ga4LiSi2
|
Li1 Ga4 Si2
| 3
|
[
1,
1,
1
] | 3
|
[
[
4.80524121,
0,
0
],
[
0,
4.80524121,
0
],
[
2.4026206,
2.4026206,
6.27620825
]
] |
agm001073542
|
[
[
4.805241181983047,
4.805241181983047,
5.009352288347127
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[
2.4026206280169533,
2.4026206280169533,
1.2668559616528725
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4.805241208043558,
4.805241208043558,
2.455808362878455
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[
2.4026206019564427,
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3.8203998871215448
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[
0,
2.402620605,
0
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[
2.402620605,
0,
0
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[
0,
0,
0
]
] |
[{"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Si", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Si"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Si",
"Si",
"Ga",
"Ga",
"Ga",
"Ga",
"Li"
] |
2023-11-16 06:57:59
|
[
0.5714285714285714,
0.14285714285714285,
0.2857142857142857
] |
[
[
1.7859201,
0,
0
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[
0,
1.7859201,
0
],
[
0,
0,
1.9769967
]
] | -22.015494
|
[
0,
0,
0,
0,
0,
0,
0
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[
[
0,
0,
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[
0,
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[
0,
0,
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[
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0.00060458
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[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | 0
| 3.031226
|
pbe
| true
|
38861e990544ea141685c415f93b756e_139_Li1Ga4Si2
|
[
"Ga",
"Li",
"Zr"
] | 6
|
ABC
|
GaLiZr
|
Li2 Zr2 Ga2
| 3
|
[
1,
1,
1
] | 3
|
[
[
5.57414289,
0,
0
],
[
0,
4.91870767,
0
],
[
2.78707144,
2.45935384,
3.80628213
]
] |
agm003091855
|
[
[
4.180607165,
3.689030755,
1.903141065
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[
1.39353572,
3.689030755,
1.903141065
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[
5.574142888793474,
1.2296769187065266,
0.9184762796412168
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[
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6.148384591293473,
2.887805850358783
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[
2.787071445,
2.459353835,
0
],
[
2.787071445,
0,
0
]
] |
[{"mass": null, "name": "Zr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zr"]}, {"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Ga",
"Ga",
"Zr",
"Zr",
"Li",
"Li"
] |
2023-11-16 06:57:59
|
[
0.3333333333333333,
0.3333333333333333,
0.3333333333333333
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[
[
1.4270302,
0,
0
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[
0,
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0
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[
0,
0,
0.5076065
]
] | -28.675829
|
[
-0.035,
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0.481,
0.481,
0.002,
0.001
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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,
0.0349639
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[
0,
0,
-0.0349639
],
[
0,
0,
0
],
[
0,
0,
0
]
] | 1.370009
| 3.266909
|
pbe
| true
|
4fc0e0b7216b31b1a523cacc8b9db8ec_74_Li2Zr2Ga2
|
[
"Ga",
"Mg",
"Sr"
] | 16
|
A5B2C
|
Ga2MgSr5
|
Sr10 Mg2 Ga4
| 3
|
[
1,
1,
1
] | 3
|
[
[
7.7357415,
-2e-8,
-3.65167719
],
[
-1.72378421,
7.54123765,
-3.65167713
],
[
0.15979755,
0.20044657,
10.35808396
]
] |
agm005926948
|
[
[
3.0554528940557524,
5.34903579065533,
3.0286613191923424
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[
4.6440499677682565,
7.3417288937978995,
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1.5277047124341925,
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4.283845583304273
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[
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3.3532034
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[
0.15461046010249388,
2.9602518287457498,
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[
4.513904197544976,
0.8103669819559268,
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[
1.6578506424550234,
6.931317218044073,
5.665372740820449
],
[
6.017144379897506,
4.781432371254249,
4.8805682114474855
]
] |
[{"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"mass": null, "name": "Sr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sr"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Sr",
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"Sr",
"Sr",
"Sr",
"Sr",
"Sr",
"Sr",
"Mg",
"Mg",
"Ga",
"Ga",
"Ga",
"Ga"
] |
2023-11-16 06:57:59
|
[
0.25,
0.125,
0.625
] |
[
[
0.606332,
0.01447522,
0.02444606
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[
0.01447522,
0.61294955,
0.03066453
],
[
0.02444606,
0.03066453,
0.64657897
]
] | -35.747168
|
[
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0
] |
[
[
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0.00304022
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[
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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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0.00514284,
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0
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[
0.00326851,
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[
-0.00326851,
-0.00409993,
0.0039706
],
[
-0.00514284,
0.00409993,
0
]
] | 0.000004
| 17.3106
|
pbe
| true
|
00bd8739f4d567764233fdde61e6d2ef_140_Sr10Mg2Ga4
|
[
"Ga",
"Mn",
"Nb"
] | 4
|
A2BC
|
GaMnNb2
|
Mn1 Nb2 Ga1
| 3
|
[
1,
1,
1
] | 3
|
[
[
4.21221256,
0,
0
],
[
0,
3.9056553,
0
],
[
0,
0,
3.9056553
]
] |
agm001215373
|
[
[
0,
0,
1.95282765
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[
0,
1.95282765,
0
],
[
2.10610628,
1.95282765,
1.95282765
],
[
2.10610628,
0,
0
]
] |
[{"mass": null, "name": "Nb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nb"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Nb",
"Nb",
"Mn",
"Ga"
] |
2023-11-16 06:57:59
|
[
0.25,
0.25,
0.5
] |
[
[
3.2327135,
0,
0
],
[
0,
3.1269813,
0
],
[
0,
0,
3.1269813
]
] | -32.779947
|
[
-0.262,
-0.262,
2.656,
-0.036
] |
[
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | 2.131514
| 4.380435
|
pbe
| true
|
c85008df11c7b4ed196aaeb5b337a322_123_Mn1Nb2Ga1
|
[
"Ga",
"Mn",
"Pu"
] | 7
|
A4B2C
|
Ga4Mn2Pu
|
Pu1 Mn2 Ga4
| 3
|
[
1,
1,
1
] | 3
|
[
[
5.15491118,
0.0002186,
0.00021871
],
[
2.57681145,
4.73323741,
0.00424202
],
[
2.57681145,
0.00192701,
4.73323891
]
] |
agm002289464
|
[
[
6.443855929956213,
2.367298933528415,
2.3684570522396426
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[
3.8646781500437877,
2.3680840864715855,
2.369242587760357
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[
5.154902781425304,
1.8861434645034645,
4.734480077053106
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[
5.153631298574696,
2.8492395554965353,
0.0032195629468942
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[
5.153631298574696,
0.0018260075476554999,
2.8492407863259643
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[
5.154902781425304,
4.733557012452344,
1.8884588536740352
],
[
0,
0,
0
]
] |
[{"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Pu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pu"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Mn",
"Mn",
"Ga",
"Ga",
"Ga",
"Ga",
"Pu"
] |
2023-11-16 06:57:59
|
[
0.5714285714285714,
0.2857142857142857,
0.14285714285714285
] |
[
[
2.6891646,
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],
[
-0.1944388,
2.4150813,
-0.1320636
],
[
-0.19453393,
-0.1320636,
2.414952
]
] | -45.741102
|
[
2.653,
2.653,
-0.045,
-0.045,
-0.059,
-0.059,
5.161
] |
[
[
-0.00077494,
0.00317979,
0.00318135
],
[
0.00077494,
-0.00317979,
-0.00318135
],
[
-0.00223779,
0.00429645,
0.00204352
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[
0.00223779,
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[
0.00223779,
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-0.00429745
],
[
-0.00223779,
0.00204142,
0.00429745
],
[
0,
0,
0
]
] | 10.497395
| 15.242222
|
pbe
| true
|
1531a251e75e775489fd5c8bfd3c84e4_139_Pu1Mn2Ga4
|
[
"Ga",
"Mn",
"Zr"
] | 6
|
ABC
|
GaMnZr
|
Zr2 Mn2 Ga2
| 3
|
[
1,
1,
1
] | 3
|
[
[
4.50193525,
0,
2.52773294
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[
1.61249082,
4.25422788,
2.40100517
],
[
0.07260661,
0.04347847,
5.14356385
]
] |
agm005696942
|
[
[
4.596263241642304,
1.573255260801483,
4.996172234898366
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1.5907694383576956,
2.724451089198517,
5.076129725101634
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[
0,
0,
0
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2.250967625,
0,
1.26386647
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[
3.057213035,
2.12711394,
2.4643690549999997
],
[
2.28727093,
0.021739235,
3.8356483949999998
]
] |
[{"mass": null, "name": "Zr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zr"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Zr",
"Zr",
"Mn",
"Mn",
"Ga",
"Ga"
] |
2023-11-16 06:57:59
|
[
0.3333333333333333,
0.3333333333333333,
0.3333333333333333
] |
[
[
4.9698434,
0.03905656,
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[
0.03905656,
5.1469603,
-0.06955939
],
[
-0.07294187,
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5.058798
]
] | -43.654764
|
[
-0.389,
-0.389,
2.231,
2.231,
-0.046,
-0.046
] |
[
[
0.00154593,
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-0.00275334
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[
-0.00154593,
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0.00275334
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[
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0,
0
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[
0,
0,
0
],
[
0,
0,
0
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[
0,
0,
0
]
] | 3.37382
| 5.949181
|
pbe
| true
|
f97bc84fd6308918bed946f767cfda50_74_Zr2Mn2Ga2
|
[
"Ga",
"N",
"Pm"
] | 7
|
A4B2C
|
Ga2NPm4
|
Pm4 Ga2 N1
| 3
|
[
1,
1,
1
] | 3
|
[
[
3.70183208,
0,
0
],
[
0,
6.16201586,
0.51518636
],
[
-1.85091604,
-2.39496883,
7.32757435
]
] |
agm003448396
|
[
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5.438125356714154
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4.569689167214575,
2.4046353532858458
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1.8509160214908396,
1.326410103249913,
1.1635455668022552
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[
1.8509160391378944e-8,
2.4406369267500874,
6.679215143197745
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[
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2.794150438192058,
4.1262757292654895
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[
0.0000018509160399790676,
0.9728965918079426,
3.71648498073451
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[
0,
0,
0
]
] |
[{"mass": null, "name": "N", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["N"]}, {"mass": null, "name": "Pm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pm"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Pm",
"Pm",
"Pm",
"Pm",
"Ga",
"Ga",
"N"
] |
2023-11-16 06:57:59
|
[
0.2857142857142857,
0.14285714285714285,
0.5714285714285714
] |
[
[
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0
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[
0,
-0.01594684,
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[
0,
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]
] | -38.192925
|
[
0,
0,
0,
0,
0,
0,
0
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[
[
0,
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-0.00008529
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0,
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[
0,
0.00099375,
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[
0,
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[
0,
0.00206967,
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[
0,
-0.00206967,
0.00226031
],
[
0,
0,
0
]
] | 0.000205
| 5.484377
|
pbe
| true
|
20815b0b7714f99479374f2f31244b29_12_Pm4Ga2N1
|
[
"Ga",
"Nd",
"Te"
] | 16
|
A4B3C
|
GaNd3Te4
|
Nd6 Ga2 Te8
| 3
|
[
1,
1,
1
] | 3
|
[
[
6.30671679,
0,
0
],
[
0,
9.53186597,
0
],
[
0,
0,
10.47640638
]
] |
agm003557311
|
[
[
3.562672765671499,
7.822971306243988,
0
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0.41051712463051954,
6.329825186192644,
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6.329825186192644,
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1.550133333939587,
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2.509530432132537
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[
0.40073301033684927,
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5.23820319
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[
3.563641288168939,
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5.23820319
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[
3.564382390458932,
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7.747733622132537
],
[
0.4110239954589318,
3.214082390087258,
7.966875947867464
]
] |
[{"mass": null, "name": "Nd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nd"]}, {"mass": null, "name": "Te", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Te"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Nd",
"Nd",
"Nd",
"Nd",
"Nd",
"Nd",
"Ga",
"Ga",
"Te",
"Te",
"Te",
"Te",
"Te",
"Te",
"Te",
"Te"
] |
2023-11-16 06:57:59
|
[
0.125,
0.375,
0.5
] |
[
[
0.46472108,
0,
0
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[
0,
0.34632516,
0
],
[
0,
0,
0.42964992
]
] | -75.99968
|
[
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
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0,
0
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[
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0
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[
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0
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0
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[
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0
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[
-0.00194355,
-0.00065683,
-0.00151338
],
[
-0.00194355,
0.00065683,
0.00151338
]
] | 0
| 7.625194
|
pbe
| true
|
c054b5bfc375801e23666b21714267a3_31_Nd6Ga2Te8
|
[
"Ga",
"Ni",
"Si"
] | 8
|
A6BC
|
GaNi6Si
|
Ga1 Si1 Ni6
| 3
|
[
1,
1,
1
] | 3
|
[
[
3.54663763,
0,
0
],
[
0,
3.54663763,
0
],
[
0,
0,
7.07541633
]
] |
agm003264146
|
[
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0,
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0
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[
0,
0,
3.537708165
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[
1.773318815,
1.773318815,
0
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1.773318815,
1.773318815,
3.537708165
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1.773318815,
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[
0,
1.773318815,
1.834037558260901
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[
0,
1.773318815,
5.2413787717390985
]
] |
[{"mass": null, "name": "Ni", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ni"]}, {"mass": null, "name": "Si", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Si"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Ga",
"Si",
"Ni",
"Ni",
"Ni",
"Ni",
"Ni",
"Ni"
] |
2023-11-16 06:57:59
|
[
0.125,
0.75,
0.125
] |
[
[
-11.432865,
0,
0
],
[
0,
-11.432865,
0
],
[
0,
0,
-10.7216215
]
] | -46.125109
|
[
-0.012,
-0.008,
0.116,
0.143,
0.124,
0.124,
0.124,
0.124
] |
[
[
0,
0,
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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[
0,
0,
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[
0,
0,
0.02936424
],
[
0,
0,
-0.02936424
],
[
0,
0,
0.02936424
]
] | 0.672388
| 8.715979
|
pbe
| true
|
380b1c75a66502a0d0b339633a6c0d55_123_Ga1Si1Ni6
|
[
"Ga",
"Pb",
"Sc"
] | 4
|
A2BC
|
GaPbSc2
|
Sc2 Ga1 Pb1
| 3
|
[
1,
1,
1
] | 3
|
[
[
0,
3.53859484,
3.53859484
],
[
3.53859484,
0,
3.53859484
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[
3.53859484,
3.53859484,
0
]
] |
agm002732727
|
[
[
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3.53859484
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[
1.76929742,
1.76929742,
1.76929742
],
[
5.30789226,
5.30789226,
5.30789226
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[
0,
0,
0
]
] |
[{"mass": null, "name": "Pb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pb"]}, {"mass": null, "name": "Sc", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sc"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Pb",
"Sc",
"Sc",
"Ga"
] |
2023-11-16 06:57:59
|
[
0.25,
0.25,
0.5
] |
[
[
4.384734,
0,
0
],
[
0,
4.384734,
0
],
[
0,
0,
4.384734
]
] | -20.81364
|
[
0,
0,
0,
0
] |
[
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | 0
| 4.090772
|
pbe
| true
|
c12a60c53d18bf2d209edbe4381e6e57_225_Sc2Ga1Pb1
|
[
"Ga",
"Pd",
"Th"
] | 14
|
A7B4C3
|
Ga4Pd7Th3
|
Th3 Ga4 Pd7
| 3
|
[
1,
1,
1
] | 3
|
[
[
4.18588291,
0,
1.05599021
],
[
1.48594289,
7.87130903,
2.93410094
],
[
0.13303955,
0.35942361,
8.2969306
]
] |
agm005700566
|
[
[
1.6590143397191228,
1.4790726637173863,
2.248056464892483
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[
4.145851010280877,
6.751659976282614,
10.038965285107517
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[
0.80949122,
4.11536632,
5.61551577
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[
3.5327707610867636,
3.689269415531576,
3.6448791890760224
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[
2.272090403030326,
4.541463224468424,
8.642141504933766
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[
5.050150619232664,
7.147652815663133,
6.4543837758799265
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[
0.7547147307673374,
1.0830798243368662,
5.832637974120074
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[
2.5827662154206488,
6.787275663725908,
7.41064963562021
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[
2.552729126015353,
2.077248031415773,
7.529706460362673
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[
4.29570145234179,
3.2033417362492855,
9.444967273683456
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[
3.2220991345793517,
1.443456976274092,
4.876372114379789
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[
1.509163897658211,
5.027390903750714,
2.8420544763165427
],
[
0,
0,
0
],
[
3.2521362239846474,
6.153484608584228,
4.757315289637327
]
] |
[{"mass": null, "name": "Th", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Th"]}, {"mass": null, "name": "Pd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pd"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Th",
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"Th",
"Ga",
"Ga",
"Ga",
"Ga",
"Pd",
"Pd",
"Pd",
"Pd",
"Pd",
"Pd",
"Pd"
] |
2023-11-16 06:57:59
|
[
0.2857142857142857,
0.5,
0.21428571428571427
] |
[
[
5.4906864,
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0.02962388
],
[
-0.04054019,
5.231009,
0.16069847
],
[
0.02962388,
0.1606981,
5.380732
]
] | -82.06099
|
[
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0
] |
[
[
0.00002717,
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-0.00010768
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[
-0.00002717,
0.00031596,
0.00010768
],
[
0,
0,
0
],
[
0.00033064,
0.00412489,
-0.00131063
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[
-0.00033064,
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0.00131063
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[
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0.00094571,
0.0032514
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[
0.00082024,
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[
0.00078606,
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[
0.00013133,
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-0.00052059
],
[
-0.00013252,
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0.00052528
],
[
-0.00078606,
0.00233006,
0.00311589
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[
0.00013252,
0.00430645,
-0.00052528
],
[
0,
0,
0
],
[
-0.00013133,
0.00256263,
0.00052059
]
] | -0.000001
| 8.724266
|
pbe
| true
|
35282736e7038ca27bf745b581b4d3ea_12_Th3Ga4Pd7
|
[
"Ga",
"Pm",
"Pt"
] | 10
|
A2B2C
|
Ga2PmPt2
|
Pm2 Ga4 Pt4
| 3
|
[
1,
1,
1
] | 3
|
[
[
4.1885142,
0,
0
],
[
0,
4.1885142,
0
],
[
0,
0,
10.91524447
]
] |
agm003387543
|
[
[
2.0942571,
0,
2.7595521571106394
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[
0,
2.0942571,
8.15569231288936
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[
2.0942571,
2.0942571,
5.457622235
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[
0,
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5.457622235
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[
0,
2.0942571,
1.4645660250556138
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[
2.0942571,
0,
9.450678444944385
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[
0,
2.0942571,
3.9642778404418966
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[
2.0942571,
0,
6.950966629558104
],
[
2.0942571,
2.0942571,
0
],
[
0,
0,
0
]
] |
[{"mass": null, "name": "Pm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pm"]}, {"mass": null, "name": "Pt", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pt"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Pm",
"Pm",
"Ga",
"Ga",
"Ga",
"Ga",
"Pt",
"Pt",
"Pt",
"Pt"
] |
2023-11-16 06:57:59
|
[
0.4,
0.2,
0.4
] |
[
[
3.8628278,
0,
0
],
[
0,
3.8628278,
0
],
[
0,
0,
4.007905
]
] | -55.46946
|
[
0,
0,
0,
0,
0,
0,
0,
0,
0,
0
] |
[
[
0,
0,
0.00338757
],
[
0,
0,
-0.00338757
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
-0.00412707
],
[
0,
0,
0.00412707
],
[
0,
0,
0.00192837
],
[
0,
0,
-0.00192837
],
[
0,
0,
0
],
[
0,
0,
0
]
] | -0.000007
| 6.001852
|
pbe
| true
|
07defaaf53fbdfce68e88d7a22dcf65b_129_Pm2Ga4Pt4
|
[
"Ga",
"Pt",
"Re"
] | 8
|
A2BC
|
GaPt2Re
|
Ga2 Re2 Pt4
| 3
|
[
1,
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agm002832189
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[
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2023-11-16 06:57:59
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pbe
| true
|
6d4495681231c0665052bee641995d8c_122_Ga2Re2Pt4
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[
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A5B5C2
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Ga5Pt5Sm2
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Sm2 Ga5 Pt5
| 3
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1,
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"Sm",
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2023-11-16 06:57:59
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pbe
| true
|
4736f206428230886c768357108628c6_47_Sm2Ga5Pt5
|
[
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A3B2C
|
Ga3Pt2Th
|
Th1 Ga3 Pt2
| 3
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[
1,
1,
1
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[
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agm002275166
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[
"Ga",
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2023-11-16 06:57:59
|
[
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| 2.300657
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pbe
| true
|
1e6b793dbf9a5b95ec15c00a3b27669d_191_Th1Ga3Pt2
|
[
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A4B2C
|
GaRb2Se4
|
Rb2 Ga1 Se4
| 3
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[
1,
1,
1
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[
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agm001077063
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[
"Ga",
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2023-11-16 06:57:59
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pbe
| true
|
28a2c6a1f4fd7e2ab8af6bfc3c248132_139_Rb2Ga1Se4
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[
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ABC
|
GaRbZr
|
Rb1 Zr1 Ga1
| 3
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[
1,
1,
1
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[
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agm003066109
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[
"Ga",
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2023-11-16 06:57:59
|
[
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| 3.547104
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pbe
| true
|
e9500de7c3a15a3c451b0f399a1e19e4_187_Rb1Zr1Ga1
|
[
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ABC
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GaRhTi
|
Ti2 Ga2 Rh2
| 3
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[
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1
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[
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agm001002202
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[
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2023-11-16 06:57:59
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[
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pbe
| true
|
84ef48643b099702cee204fc76d48ad8_63_Ti2Ga2Rh2
|
[
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A3BC
|
GaRh3U
|
U2 Ga2 Rh6
| 3
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[
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1
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[
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agm003713220
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[
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2023-11-16 06:57:59
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pbe
| true
|
65e98dc35e4fefc5fcbd58a6825029d3_63_U2Ga2Rh6
|
[
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A5B2C
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GaRh5Zr2
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Zr4 Ga2 Rh10
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agm005972791
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2023-11-16 06:57:59
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[
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0,
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| 11.685048
|
pbe
| true
|
aefa267ce7e073e390ad2b40fc354c5c_55_Zr4Ga2Rh10
|
[
"Ga",
"Ru",
"Tm"
] | 8
|
A5B2C
|
Ga5RuTm2
|
Tm2 Ga5 Ru1
| 3
|
[
1,
1,
1
] | 3
|
[
[
5.90639187,
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0.1744614
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[
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5.20121815,
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agm003478662
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|
[
"Tm",
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"Ga",
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"Ga",
"Ga",
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2023-11-16 06:57:59
|
[
0.625,
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0.25
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[
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| 3.334143
|
pbe
| true
|
c3ca0dd79e9620edef9f66e219f2eb60_107_Tm2Ga5Ru1
|
[
"Ga",
"S",
"Sm"
] | 15
|
A8B6C
|
Ga6S8Sm
|
Sm1 Ga6 S8
| 3
|
[
1,
1,
1
] | 3
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[
[
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agm003700717
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|
[
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"Ga",
"Ga",
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"S",
"S",
"S",
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"S",
"S"
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2023-11-16 06:57:59
|
[
0.4,
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[
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[
0.00208724,
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| 9.422718
|
pbe
| true
|
3cd5f333e53a70ad14b8c9e74c606573_148_Sm1Ga6S8
|
[
"Ga",
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"Sn"
] | 5
|
A2B2C
|
Ga2ScSn2
|
Sc1 Ga2 Sn2
| 3
|
[
1,
1,
1
] | 3
|
[
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0,
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agm002944016
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|
[
"Sc",
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2023-11-16 06:57:59
|
[
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[
0,
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| 4.063849
|
pbe
| true
|
c73f8aae4d187f1ffe8575ed15e96c65_139_Sc1Ga2Sn2
|
[
"Ga",
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"Tc"
] | 5
|
A3BC
|
GaSn3Tc
|
Ga1 Tc1 Sn3
| 3
|
[
1,
1,
1
] | 3
|
[
[
5.18657396,
0,
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[
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agm002482384
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[{"mass": null, "name": "Sn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sn"]}, {"mass": null, "name": "Tc", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tc"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Sn",
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2023-11-16 06:57:59
|
[
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[
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[
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0,
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| 5.922963
|
pbe
| true
|
f324e3ae60b05db1dca09fbbe64c8f7b_221_Ga1Tc1Sn3
|
[
"Ga",
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"Tm"
] | 3
|
ABC
|
GaTcTm
|
Tm1 Ga1 Tc1
| 3
|
[
1,
1,
1
] | 3
|
[
[
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0,
0
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[
0,
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agm001836538
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[
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[{"mass": null, "name": "Tc", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tc"]}, {"mass": null, "name": "Tm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tm"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}]
|
[
"Tm",
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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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| 2.92258
|
pbe
| true
|
e85be53441fe863a45992fb2ec117057_107_Tm1Ga1Tc1
|
[
"Ga",
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"Y"
] | 6
|
ABC
|
GaTeY
|
Y2 Ga2 Te2
| 3
|
[
1,
1,
1
] | 3
|
[
[
4.29765666,
0,
0
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[
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agm001021044
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[
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[{"mass": null, "name": "Te", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Te"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}]
|
[
"Y",
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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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[
0,
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| 2.493416
|
pbe
| true
|
4b35eda3c3df5bfa6f4909b9cf98c27b_166_Y2Ga2Te2
|
[
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] | 16
|
A4B3C
|
GaTe3Y4
|
Y8 Ga2 Te6
| 3
|
[
1,
1,
1
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|
[
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agm006011520
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[{"mass": null, "name": "Te", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Te"]}, {"mass": null, "name": "Ga", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ga"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}]
|
[
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2023-11-16 06:57:59
|
[
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[
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[
0,
0,
0.0008276
],
[
0,
0,
0.00223463
],
[
0,
0,
0.0042452
],
[
0,
0,
-0.0042452
]
] | -0
| 2.548449
|
pbe
| true
|
a26b99bff98d62be4583b45c837b8654_13_Y8Ga2Te6
|
[
"Ga",
"Zn",
"Zr"
] | 8
|
A6BC
|
GaZnZr6
|
Zr6 Zn1 Ga1
| 3
|
[
1,
1,
1
] | 3
|
[
[
4.84189126,
-0.46543833,
1.30440855
],
[
-0.90323022,
4.77947698,
1.30491042
],
[
0.1234668,
0.13451007,
7.4348151
]
] |
agm005823372
|
[
[
3.0098336809681836,
3.2962320055293213,
5.694246170760716
],
[
2.9726822744674823,
0.3711261311302521,
6.664395754721246
],
[
0.10029661749996238,
2.9936140287535826,
6.664716741165447
],
[
1.0894455655325173,
4.077422588869748,
3.379738315278753
],
[
1.0522941590318158,
1.1523167144706792,
4.349887899239283
],
[
3.9618312225000376,
1.454934691246418,
3.3794173288345535
],
[
0,
0,
0
],
[
1.9693305199999998,
2.1570193250000003,
1.304659485
]
] |
[{"mass": null, "name": "Zr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zr"]}, {"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"]}]
|
[
"Zr",
"Zr",
"Zr",
"Zr",
"Zr",
"Zr",
"Zn",
"Ga"
] |
2023-11-16 06:57:59
|
[
0.125,
0.125,
0.75
] |
[
[
2.6232417,
-0.06415114,
-0.10529175
],
[
-0.06415114,
2.6115623,
-0.11535579
],
[
-0.10529175,
-0.11535579,
2.832896
]
] | -57.124609
|
[
0,
0,
0,
0,
0,
0,
0,
0
] |
[
[
0.00103822,
0.00113758,
-0.00344797
],
[
0.00067554,
0.00074019,
-0.0022435
],
[
0.00067554,
0.00074019,
-0.0022435
],
[
-0.00067554,
-0.00074019,
0.0022435
],
[
-0.00103822,
-0.00113758,
0.00344797
],
[
-0.00067554,
-0.00074019,
0.0022435
],
[
0,
0,
0
],
[
0,
0,
0
]
] | -0.000008
| 8.722931
|
pbe
| true
|
dcf62ac19a2bce94d475000f43f2600b_69_Zr6Zn1Ga1
|
[
"Gd",
"H",
"Th"
] | 5
|
A3BC
|
Gd3HTh
|
Gd3 Th1 H1
| 3
|
[
1,
1,
1
] | 3
|
[
[
5.03008801,
0,
0
],
[
0,
5.03008801,
0
],
[
0,
0,
5.03008801
]
] |
agm001105790
|
[
[
0,
0,
0
],
[
0,
2.515044005,
0
],
[
0,
0,
2.515044005
],
[
2.515044005,
0,
0
],
[
2.515044005,
2.515044005,
2.515044005
]
] |
[{"mass": null, "name": "Gd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Gd"]}, {"mass": null, "name": "H", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["H"]}, {"mass": null, "name": "Th", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Th"]}]
|
[
"H",
"Gd",
"Gd",
"Gd",
"Th"
] |
2023-11-16 06:57:59
|
[
0.6,
0.2,
0.2
] |
[
[
3.2089841,
0,
0
],
[
0,
3.2089841,
0
],
[
0,
0,
3.2089841
]
] | -53.681183
|
[
-0.017,
7.039,
7.039,
7.039,
-0.15
] |
[
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | 21.228657
| 5.214923
|
pbe
| true
|
fcb49425adcd06d55afb80ab44500c92_221_Gd3Th1H1
|
[
"Gd",
"Ho",
"Zr"
] | 3
|
ABC
|
GdHoZr
|
Gd1 Ho1 Zr1
| 3
|
[
1,
1,
1
] | 3
|
[
[
3.39418595,
0,
0
],
[
0,
3.39418595,
0
],
[
-1.69709298,
-1.69709298,
7.39102226
]
] |
agm001844043
|
[
[
-2.040530344910244e-8,
-2.040530344910244e-8,
5.0767061236206
],
[
1.6970929734532965,
1.6970929734532965,
2.2863438518035366
],
[
-1.8923200367796172e-11,
-1.8923200367796172e-11,
0.0279723584860864
]
] |
[{"mass": null, "name": "Gd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Gd"]}, {"mass": null, "name": "Zr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zr"]}, {"mass": null, "name": "Ho", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ho"]}]
|
[
"Gd",
"Ho",
"Zr"
] |
2023-11-16 06:57:59
|
[
0.3333333333333333,
0.3333333333333333,
0.3333333333333333
] |
[
[
2.1700246,
0,
0
],
[
0,
2.1700246,
0
],
[
0,
0,
2.04017
]
] | -26.966972
|
[
7.156,
0.078,
-0.037
] |
[
[
0,
0,
0.0024692
],
[
0,
0,
-0.0051138
],
[
0,
0,
0.0026446
]
] | 7.425548
| 4.185608
|
pbe
| true
|
cb61257dfde26a407770ca0b4122f869_107_Gd1Ho1Zr1
|
[
"Gd",
"Ho",
"Zr"
] | 4
|
A2BC
|
Gd2HoZr
|
Gd2 Ho1 Zr1
| 3
|
[
1,
1,
1
] | 3
|
[
[
4.87796252,
0,
0
],
[
0,
4.86863478,
0
],
[
0,
0,
4.86863478
]
] |
agm001233745
|
[
[
0,
0,
2.43431739
],
[
0,
2.43431739,
0
],
[
2.43898126,
2.43431739,
2.43431739
],
[
2.43898126,
0,
0
]
] |
[{"mass": null, "name": "Gd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Gd"]}, {"mass": null, "name": "Zr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zr"]}, {"mass": null, "name": "Ho", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ho"]}]
|
[
"Gd",
"Gd",
"Ho",
"Zr"
] |
2023-11-16 06:57:59
|
[
0.5,
0.25,
0.25
] |
[
[
2.3129656,
0,
0
],
[
0,
2.3140492,
0
],
[
0,
0,
2.3140492
]
] | -40.889944
|
[
-7.083,
-7.083,
0.071,
0.244
] |
[
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | -13.994658
| 5.409597
|
pbe
| true
|
f8f12b70e37e138860a910fddd7ba4e5_123_Gd2Ho1Zr1
|
[
"Gd",
"K",
"Te"
] | 4
|
A2BC
|
GdKTe2
|
Gd1 K1 Te2
| 3
|
[
1,
1,
1
] | 3
|
[
[
4.37773895,
-0.0005742,
7.4296037
],
[
2.0256494,
3.88089464,
7.4296037
],
[
-0.00094756,
-0.0005742,
8.62343369
]
] |
mp-20420
|
[
[
3.201220395,
1.9398731200000001,
11.741320545
],
[
1.682065826670446,
1.0192969807155616,
6.169420287205223
],
[
4.720374963329554,
2.860449259284439,
17.313220802794778
],
[
0,
0,
0
]
] |
[{"mass": null, "name": "Gd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Gd"]}, {"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}, {"mass": null, "name": "Te", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Te"]}]
|
[
"K",
"Te",
"Te",
"Gd"
] |
2014-02-21 06:17:48
|
[
0.25,
0.25,
0.5
] |
[
[
0.49700895,
-0.0268239,
-0.16235494
],
[
-0.0268239,
0.5250196,
-0.09838372
],
[
-0.16235494,
-0.09838372,
-0.05420525
]
] | -27.135227
|
[] |
[
[
0,
0,
0
],
[
0.01924431,
0.01166166,
0.0705836
],
[
-0.01924431,
-0.01166166,
-0.0705836
],
[
0,
0,
0
]
] | null | 2.725956
|
pbe
| true
|
387c0cdb3f72ec7bdf8bd03793136c46_166_K1Gd1Te2
|
[
"Gd",
"Ni",
"Tm"
] | 3
|
ABC
|
GdNiTm
|
Gd1 Tm1 Ni1
| 3
|
[
1,
1,
1
] | 3
|
[
[
4.72981097,
0,
0
],
[
2.36490548,
4.09613645,
0
],
[
2.36490548,
1.36537882,
3.86187448
]
] |
agm001238394
|
[
[
0,
0,
0
],
[
2.3649054825,
1.3653788175000001,
0.96546862
],
[
4.729810965,
2.7307576350000002,
1.93093724
]
] |
[{"mass": null, "name": "Gd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Gd"]}, {"mass": null, "name": "Ni", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ni"]}, {"mass": null, "name": "Tm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tm"]}]
|
[
"Gd",
"Ni",
"Tm"
] |
2023-11-16 06:57:59
|
[
0.3333333333333333,
0.3333333333333333,
0.3333333333333333
] |
[
[
-2.206103,
0,
0
],
[
0,
-2.206103,
0
],
[
0,
0,
-2.206103
]
] | -24.828137
|
[
7.052,
-0.042,
0.056
] |
[
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | 7.211483
| 2.903799
|
pbe
| true
|
47f38faf8227e728ef2ca09987e22927_216_Gd1Tm1Ni1
|
[
"Gd",
"Ni",
"Zr"
] | 4
|
A2BC
|
GdNi2Zr
|
Gd1 Zr1 Ni2
| 3
|
[
1,
1,
1
] | 3
|
[
[
3.29592625,
0,
0
],
[
0,
3.29592625,
0
],
[
0,
0,
6.7593382
]
] |
agm001135582
|
[
[
0,
0,
5.3629806635609825
],
[
0,
0,
1.396357536439018
],
[
1.647963125,
1.647963125,
3.3796691
],
[
1.647963125,
1.647963125,
0
]
] |
[{"mass": null, "name": "Gd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Gd"]}, {"mass": null, "name": "Zr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zr"]}, {"mass": null, "name": "Ni", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ni"]}]
|
[
"Ni",
"Ni",
"Gd",
"Zr"
] |
2023-11-16 06:57:59
|
[
0.25,
0.5,
0.25
] |
[
[
-4.139429,
0,
0
],
[
0,
-4.139429,
0
],
[
0,
0,
-4.3688188
]
] | -35.609915
|
[
-0.009,
-0.009,
-7.074,
-0.02
] |
[
[
0,
0,
-0.0061615
],
[
0,
0,
0.0061615
],
[
0,
0,
0
],
[
0,
0,
0
]
] | -7.280776
| 4.6463
|
pbe
| true
|
fe21618372fa1a7d0798710d12555cfa_123_Gd1Zr1Ni2
|
[
"Gd",
"Pt",
"Sn"
] | 3
|
ABC
|
GdPtSn
|
Gd1 Sn1 Pt1
| 3
|
[
1,
1,
1
] | 3
|
[
[
4.73343621,
0,
0
],
[
2.3667181,
4.099276,
-3e-8
],
[
2.3667181,
1.36642553,
3.86483435
]
] |
agm002320227
|
[
[
0,
0,
0
],
[
4.733436205,
2.732850765,
1.9324171600000002
],
[
2.3667181025,
1.3664253825,
0.9662085800000001
]
] |
[{"mass": null, "name": "Gd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Gd"]}, {"mass": null, "name": "Sn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sn"]}, {"mass": null, "name": "Pt", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pt"]}]
|
[
"Gd",
"Sn",
"Pt"
] |
2023-11-16 06:57:59
|
[
0.3333333333333333,
0.3333333333333333,
0.3333333333333333
] |
[
[
5.112943,
0,
0
],
[
0,
5.112943,
2.3e-7
],
[
0,
2.3e-7,
5.1129427
]
] | -27.139441
|
[
7.124,
0.096,
0.09
] |
[
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | 7.612195
| 3.714599
|
pbe
| true
|
0e4232736dff2e5d69fb4a7f0b383b62_216_Gd1Sn1Pt1
|
[
"Gd",
"S",
"Se"
] | 3
|
ABC
|
GdSSe
|
Gd1 Se1 S1
| 3
|
[
1,
1,
1
] | 3
|
[
[
5.80992465,
0,
0
],
[
0,
4.18445635,
0
],
[
0,
-2.09222818,
3.6238455
]
] |
agm001413712
|
[
[
4.4382797579192825,
2.0922281942556147,
1.207948487920515
],
[
5.7044600508901215,
0,
0
],
[
1.4771094911905964,
-2.4255615515495406e-8,
2.415897012079485
]
] |
[{"mass": null, "name": "S", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["S"]}, {"mass": null, "name": "Se", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Se"]}, {"mass": null, "name": "Gd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Gd"]}]
|
[
"S",
"Gd",
"Se"
] |
2023-11-16 06:57:59
|
[
0.3333333333333333,
0.3333333333333333,
0.3333333333333333
] |
[
[
0.27336758,
0,
0
],
[
0,
0.39266127,
0
],
[
0,
0,
0.39266127
]
] | -25.611968
|
[
-0.194,
6.894,
-0.288
] |
[
[
0.00243337,
0,
0
],
[
0.00083526,
0,
0
],
[
-0.00326863,
0,
0
]
] | 6.222305
| 3.146188
|
pbe
| true
|
be7171dcde20e97c26fd6156d4b82687_156_Gd1Se1S1
|
[
"Gd",
"Se",
"Tb"
] | 3
|
ABC
|
GdSeTb
|
Tb1 Gd1 Se1
| 3
|
[
1,
1,
1
] | 3
|
[
[
3.88690611,
0,
0
],
[
-1.94345305,
3.36615943,
0
],
[
0,
0,
6.57782136
]
] |
agm001264981
|
[
[
0,
0,
0.3395333909565576
],
[
-1.6101197246429356e-8,
2.2441062978871984,
4.038884468605721
],
[
1.9434530761011974,
1.122053132112802,
2.199403566215935
]
] |
[{"mass": null, "name": "Gd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Gd"]}, {"mass": null, "name": "Tb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tb"]}, {"mass": null, "name": "Se", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Se"]}]
|
[
"Gd",
"Tb",
"Se"
] |
2023-11-16 06:57:59
|
[
0.3333333333333333,
0.3333333333333333,
0.3333333333333333
] |
[
[
0.9709214,
0,
0
],
[
0,
0.9709214,
0
],
[
0,
0,
1.0631148
]
] | -25.610319
|
[
7.288,
0.296,
-0.003
] |
[
[
0,
0,
0.00334601
],
[
0,
0,
-0.00133859
],
[
0,
0,
-0.00200743
]
] | 8.257535
| 3.230546
|
pbe
| true
|
f8b3b15fb1e2c157973b47e2d5e4e2b8_156_Tb1Gd1Se1
|
[
"Gd",
"Tb",
"Y"
] | 4
|
A2BC
|
GdTb2Y
|
Tb2 Gd1 Y1
| 3
|
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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2023-11-16 06:57:59
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