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[ "Mg", "O", "V", "Y" ]
16
A8B6CD
Mg6O8VY
Y1 Mg6 V1 O8
4
[ 1, 1, 1 ]
3
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agm005289949
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[ "Y", "Mg", "Mg", "Mg", "Mg", "Mg", "Mg", "V", "O", "O", "O", "O", "O", "O", "O", "O" ]
2023-11-16 06:57:59
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2.532976
1.114318
pbe
true
5814d8dd0501ee1fea5d4725f1072c05_123_Y1Mg6V1O8
[ "Cd", "W", "Zr" ]
4
A2BC
CdWZr2
Cd1 W1 Zr2
3
[ 1, 1, 1 ]
3
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oqmd-7214232
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[ "Cd", "W", "Zr", "Zr" ]
2024-11-01 00:00:00
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0.096784
null
pbe
true
65b2f87d5ca4f0c79e5b8c75b1729263_216_Zr2Cd1W1
[ "Mg", "O", "V", "Zn" ]
20
A6B2CD
MgO6V2Zn
Mg2 V4 Zn2 O12
4
[ 1, 1, 1 ]
3
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agm004976315
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[ "Mg", "Mg", "V", "V", "V", "V", "Zn", "Zn", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2023-11-16 06:57:59
[ 0.1, 0.6, 0.2, 0.1 ]
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-134.205189
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4
0
pbe
true
bda16059dd2de1831d5989baf889c76f_15_Mg2V4Zn2O12
[ "Ge", "Si", "Ti" ]
8
A2BC
Ge2SiTi
Ti2 Si2 Ge4
3
[ 1, 1, 1 ]
3
[ [ 7.16723852, 0, 0 ], [ 0, 7.16723852, 0 ], [ 3.58361926, 3.58361926, 2.69698696 ] ]
agm002893956
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[ "Ge", "Ge", "Ge", "Ge", "Si", "Si", "Ti", "Ti" ]
2023-11-16 06:57:59
[ 0.5, 0.25, 0.25 ]
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-0.000001
5.343103
pbe
true
fc863fab759843b487462f46861ff248_122_Ti2Si2Ge4
[ "Mg", "Os", "Pm", "Si" ]
5
A2BCD
MgOsPmSi2
Pm1 Mg1 Si2 Os1
4
[ 1, 1, 1 ]
3
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agm005019513
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[ "Pm", "Mg", "Si", "Si", "Os" ]
2023-11-16 06:57:59
[ 0.2, 0.2, 0.2, 0.4 ]
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0.000077
4.01385
pbe
true
cae60e3b521691f805dccb6e5e03faef_119_Pm1Mg1Si2Os1
[ "Ge", "Si", "Tl" ]
5
A2B2C
Ge2Si2Tl
Tl1 Si2 Ge2
3
[ 1, 1, 1 ]
3
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agm002946172
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[ "Tl", "Si", "Si", "Ge", "Ge" ]
2023-11-16 06:57:59
[ 0.4, 0.4, 0.2 ]
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0
1.947421
pbe
true
fc9b7de050566854617a7c3b09f13eac_139_Tl1Si2Ge2
[ "Cd", "Y", "Zn" ]
4
A2BC
Cd2YZn
Y1 Zn1 Cd2
3
[ 1, 1, 1 ]
3
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agm004081505
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[{"mass": null, "name": "Cd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cd"]}, {"mass": null, "name": "Zn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zn"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}]
[ "Cd", "Cd", "Y", "Zn" ]
2023-11-16 06:57:59
[ 0.5, 0.25, 0.25 ]
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0.240374
1.943848
pbe
true
ebcf7f47ed02e2e68d2ebdbbd9656c0c_99_Y1Zn1Cd2
[ "Ce", "Co", "Os" ]
4
A2BC
Ce2CoOs
Ce2 Co1 Os1
3
[ 1, 1, 1 ]
3
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agm001971080
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[ "Co", "Os", "Ce", "Ce" ]
2023-11-16 06:57:59
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0.578098
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pbe
true
3379d47c7d29d79254eebf4fcbcd606c_166_Ce2Co1Os1
[ "Ce", "Co", "P" ]
4
A2BC
Ce2CoP
Ce2 Co1 P1
3
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3
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agm001968276
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[ "P", "Co", "Ce", "Ce" ]
2023-11-16 06:57:59
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7895dd18a3540425bd14665205fd92a5_166_Ce2Co1P1
[ "Ce", "Co", "V" ]
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ABC
CeCoV
Ce1 V1 Co1
3
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3
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agm001842675
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[ "Co", "Ce", "V" ]
2023-11-16 06:57:59
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pbe
true
638bfc3b6ce3bba06aa490dea3660918_107_Ce1V1Co1
[ "Ce", "Cs", "I" ]
32
A5B2C
CeCs2I5
Cs8 Ce4 I20
3
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3
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agm005898405
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[{"mass": null, "name": "Ce", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ce"]}, {"mass": null, "name": "I", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["I"]}, {"mass": null, "name": "Cs", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cs"]}]
[ "Cs", "Cs", "Cs", "Cs", "Cs", "Cs", "Cs", "Cs", "Ce", "Ce", "Ce", "Ce", "I", "I", "I", "I", "I", "I", "I", "I", "I", "I", "I", "I", "I", "I", "I", "I", "I", "I", "I", "I" ]
2023-11-16 06:57:59
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4.000129
32.509903
pbe
true
10dd9f1ad27621feb84315c7d05fe566_62_Cs8Ce4I20
[ "Mg", "Pd", "Pr", "Si" ]
5
A2BCD
MgPdPrSi2
Pr1 Mg1 Si2 Pd1
4
[ 1, 1, 1 ]
3
[ [ 4.17002685, 0, 0 ], [ 0, 4.17002685, 0 ], [ -2.08501342, -2.08501342, 5.46648304 ] ]
agm005019275
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[ "Pr", "Mg", "Si", "Si", "Pd" ]
2023-11-16 06:57:59
[ 0.2, 0.2, 0.2, 0.4 ]
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-0.000002
1.635383
pbe
true
60c720ece610ca7005616fc38d4df6d7_119_Pr1Mg1Si2Pd1
[ "Mn", "Te" ]
11
A6B5
Mn5Te6
Mn5 Te6
2
[ 1, 1, 1 ]
3
[ [ 7.60331535, 0, 0 ], [ -3.80165767, 6.58466425, 0 ], [ 0, 0, 19.11007161 ] ]
agm2000049717
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[{"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Te", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Te"]}]
[ "Te", "Te", "Te", "Te", "Te", "Te", "Mn", "Mn", "Mn", "Mn", "Mn" ]
2023-11-16 06:57:59
[ 0.45454545454545453, 0.5454545454545454 ]
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-61.560521
[ -0.099, -0.099, -0.099, -0.019, -0.019, 0.185, 3.67, 3.67, 3.67, 2.391, 2.391 ]
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17.15469
7.410554
pbe
true
c37da628b77e3c2beebcc726332452e4_183_Mn5Te6
[ "Pm", "Sn", "Tb" ]
4
A2BC
Pm2SnTb
Tb1 Pm2 Sn1
3
[ 1, 1, 1 ]
3
[ [ 4.260757, 0, 0 ], [ 0, 4.260757, 0 ], [ 0, 0, 6.71501021 ] ]
agm001129128
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[{"mass": null, "name": "Tb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tb"]}, {"mass": null, "name": "Sn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sn"]}, {"mass": null, "name": "Pm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pm"]}]
[ "Tb", "Sn", "Pm", "Pm" ]
2023-11-16 06:57:59
[ 0.5, 0.25, 0.25 ]
[ [ 1.3756609, 0, 0 ], [ 0, 1.3756609, 0 ], [ 0, 0, 1.1943411 ] ]
-19.568917
[ 0, 0, 0, 0 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, -0.00132067 ], [ 0, 0, 0.00132067 ] ]
-0
4.001886
pbe
true
a84922f8d9b99da9f6cf4827bdc4e5f9_123_Tb1Pm2Sn1
[ "Mn", "Tl" ]
24
A2B
MnTl2
Mn8 Tl16
2
[ 1, 1, 1 ]
3
[ [ 10.49312535, 0.28730851, 0 ], [ 5.02299366, 9.21844491, 0 ], [ 0, 0, 20.12127636 ] ]
agm2000034552
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[{"mass": null, "name": "Tl", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tl"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}]
[ "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Mn", "Mn", "Mn", "Mn", "Mn", "Mn", "Mn", "Mn" ]
2023-11-16 06:57:59
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-97.570539
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29.617876
18.547966
pbe
true
16aac10aa70f07db14f56c9e40c9245c_59_Mn8Tl16
[ "Na", "Nb" ]
4
AB
NaNb
Na2 Nb2
2
[ 1, 1, 1 ]
3
[ [ 2.61783968, 0, -0.00270437 ], [ 0, 5.02808918, 0 ], [ -0.37943675, 0, 6.74072642 ] ]
agm002109505
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[{"mass": null, "name": "Nb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nb"]}, {"mass": null, "name": "Na", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Na"]}]
[ "Na", "Na", "Nb", "Nb" ]
2023-11-16 06:57:59
[ 0.5, 0.5 ]
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-20.288567
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0.000033
3.323464
pbe
true
d5b75aae0921fce857330d590cde207e_11_Na2Nb2
[ "Na", "Pm" ]
4
AB
NaPm
Na1 Pm1
2
[ 1, 1, 1 ]
3
[ [ 4.919117668, 0, 0 ], [ -2.459558834, 4.260080865, 0 ], [ 0, 0, 6.906660432 ] ]
oqmd-5414509
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[{"mass": null, "name": "Na", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Na"]}, {"mass": null, "name": "Pm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pm"]}]
[ "Na", "Na", "Pm", "Pm" ]
2024-11-01 00:00:00
[ 0.5, 0.5 ]
[ [ 12.33501779, 0, 0 ], [ 0, 12.33501779, 0 ], [ 0, 0, 11.54611774 ] ]
-9.03551
[ 0.003, 0.003, 0.055, 0.055 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
0.29049
null
pbe
true
0e6e332cab150c7e1824a8aad1bbd64f_194_Na2Pm2
[ "Pm", "Tb", "Y" ]
4
A2BC
PmTbY2
Tb1 Pm1 Y2
3
[ 1, 1, 1 ]
3
[ [ 3.58777862, 0, 0 ], [ 0, 3.58777862, 0 ], [ 0, 0, 10.15731011 ] ]
agm001124757
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[{"mass": null, "name": "Tb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tb"]}, {"mass": null, "name": "Pm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pm"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}]
[ "Y", "Y", "Tb", "Pm" ]
2023-11-16 06:57:59
[ 0.25, 0.25, 0.5 ]
[ [ 1.8953431, 0, 0 ], [ 0, 1.8953431, 0 ], [ 0, 0, 1.6532812 ] ]
-22.227719
[ 0, 0, 0, 0 ]
[ [ 0, 0, -0.00448076 ], [ 0, 0, 0.00448076 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
0.000001
5.623577
pbe
true
27e1b6a95c1a5bce7cf888b852478c55_123_Tb1Pm1Y2
[ "Ge", "Sn", "Ti" ]
8
A6BC
GeSnTi6
Ti6 Sn1 Ge1
3
[ 1, 1, 1 ]
3
[ [ 4.67273571, 0, 0 ], [ 0, 5.11970435, -2.61892232 ], [ 0, -0.08154198, 5.75008508 ] ]
agm005804669
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[{"mass": null, "name": "Ge", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ge"]}, {"mass": null, "name": "Sn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sn"]}, {"mass": null, "name": "Ti", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ti"]}]
[ "Ti", "Ti", "Ti", "Ti", "Ti", "Ti", "Sn", "Ge" ]
2023-11-16 06:57:59
[ 0.125, 0.125, 0.75 ]
[ [ 2.583417, 0, 0 ], [ 0, 2.8152518, 0.16343659 ], [ 0, 0.16343659, 2.65385 ] ]
-58.690346
[ 0, 0, 0, 0, 0, 0, 0, 0 ]
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-0.000279
6.914044
pbe
true
031913e31c331a9eb71afb0eb41737ba_38_Ti6Sn1Ge1
[ "Na", "Rb" ]
4
A3B
Na3Rb
Rb1 Na3
2
[ 1, 1, 1 ]
3
[ [ 5.82107134, 0, 0 ], [ 0, 5.82107134, 0 ], [ 0, 0, 5.82107134 ] ]
agm002165513
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[{"mass": null, "name": "Na", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Na"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
[ "Na", "Na", "Na", "Rb" ]
2023-11-16 06:57:59
[ 0.75, 0.25 ]
[ [ -0.05497364, 0, 0 ], [ 0, -0.05497364, 0 ], [ 0, 0, -0.05497364 ] ]
-4.657157
[ 0.001, -0.001, 0, 0 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
0.000001
2.350921
pbe
true
e35187293e6d2f1c973511582fda6686_221_Rb1Na3
[ "Mg", "Pm", "Pt", "Sc" ]
5
A2BCD
MgPmPt2Sc
Pm1 Mg1 Sc1 Pt2
4
[ 1, 1, 1 ]
3
[ [ 4.17699427, 0, 0 ], [ 0, 4.17699427, 0 ], [ -2.08849714, -2.08849713, 6.1721702 ] ]
agm005018103
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[{"mass": null, "name": "Sc", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sc"]}, {"mass": null, "name": "Mg", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mg"]}, {"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"]}]
[ "Pm", "Mg", "Sc", "Pt", "Pt" ]
2023-11-16 06:57:59
[ 0.2, 0.2, 0.4, 0.2 ]
[ [ 3.6881042, 0, 0 ], [ 0, 3.6881042, 0 ], [ 0, 0, 3.7387252 ] ]
-29.619104
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0.00004
2.740549
pbe
true
1310f750726deeafc11f80d8df390bcd_119_Pm1Mg1Sc1Pt2
[ "K", "Ni", "S", "Ta" ]
12
A3BCD
KNiS3Ta
K1 Ni1 S3 Ta1
4
[ 1, 1, 1 ]
3
[ [ 1.742854465, -7.293580602, 0 ], [ 1.742854465, 7.293580602, 0 ], [ 0, 0, 9.357666842 ] ]
oqmd-5648078
[ [ 1.7428500000000005, -3.6166299999999953, 2.3394199999999983 ], [ 1.7428500000000002, 3.616629999999995, 7.018250000000002 ], [ 1.7428500000000005, 0.4259400000000015, 2.3394199999999983 ], [ 1.7428500000000002, -0.42594000000000176, 7.018250000000002 ], [ 1.7428500000000002, 1.715849999999999, 0.5159100000000002 ], [ 1.742850000000001, 6.3248700000000015, 2.3394199999999983 ], [ 1.7428500000000002, 1.715849999999999, 4.162930000000002 ], [ 1.7428500000000002, -1.7158499999999988, 5.194739999999999 ], [ 1.7428500000000002, -6.324870000000002, 7.018250000000002 ], [ 1.7428500000000002, -1.7158499999999988, 8.841759999999997 ], [ 0, 0, 0 ], [ 0, 0, 4.678830000000004 ] ]
[{"mass": null, "name": "K", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["K"]}, {"mass": null, "name": "Ni", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ni"]}, {"mass": null, "name": "S", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["S"]}, {"mass": null, "name": "Ta", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ta"]}]
[ "K", "K", "Ni", "Ni", "S", "S", "S", "S", "S", "S", "Ta", "Ta" ]
2024-11-01 00:00:00
[ 0.16666666666666666, 0.16666666666666666, 0.5, 0.16666666666666666 ]
[ [ 4.71020871, 0, 0 ], [ 0, 3.67796961, 0 ], [ 0, 0, 5.96325546 ] ]
-73.7064
[ 0, 0, -0.002, -0.002, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ [ 0, -0.003031, 0 ], [ 0, 0.003031, 0 ], [ 0, 0.030579, 0 ], [ 0, -0.030579, 0 ], [ 0, -0.006979, 0.013769 ], [ 0, 0.004327, 0 ], [ 0, -0.006979, -0.013769 ], [ 0, 0.006979, 0.013769 ], [ 0, -0.004327, 0 ], [ 0, 0.006979, -0.013769 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
-0.014878
null
pbe
true
1acd3a36531bf16c7ec8801de028c4c1_63_K2Ta2Ni2S6
[ "Na", "Rb" ]
4
A3B
NaRb3
Rb3 Na1
2
[ 1, 1, 1 ]
3
[ [ 5.1806314, 0, 0 ], [ 0, 7.63063185, 0 ], [ -2.5903157, -3.81531592, 7.65802665 ] ]
agm001282619
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[{"mass": null, "name": "Na", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Na"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}]
[ "Na", "Rb", "Rb", "Rb" ]
2023-11-16 06:57:59
[ 0.25, 0.75 ]
[ [ 0.22532935, 0, 0 ], [ 0, 0.10788585, 0 ], [ 0, 0, 0.07283277 ] ]
-4.096032
[ 0, 0, 0, 0 ]
[ [ 0, -0.00263535, 0 ], [ 0, 0.00193789, 0.00426821 ], [ 0, -0.00124042, 0 ], [ 0, 0.00193789, -0.00426821 ] ]
-0
3.18121
pbe
true
87cd3cc3a07b53bb34e328346f4abe8d_44_Rb3Na1
[ "Li", "Mn", "O", "Sn" ]
24
A6B3C2D
Li3Mn2O6Sn
Li6 Mn4 O12 Sn2
4
[ 1, 1, 1 ]
3
[ [ -3.49362363, -4.25215264, -2.59814329 ], [ 6.27390702, -1.47165014, -2.68781126 ], [ 0.01039779, -3.22229106, 5.25062233 ] ]
mp-1317444
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[{"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "Sn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sn"]}]
[ "Li", "Li", "Li", "Li", "Li", "Li", "Mn", "Mn", "Mn", "Mn", "Sn", "Sn", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2020-04-29 22:07:49
[ 0.25, 0.16666666666666666, 0.5, 0.08333333333333333 ]
[ [ 1.59973656, 0.01269011, 0.02201005 ], [ 0.01268956, 0.73989387, 0.36533171 ], [ 0.02390781, 0.36945724, 1.0076776 ] ]
-151.419744
[ -0.002, 0.005, 0.001, -0.005, -0.005, 0.001, -4.594, -4.594, 3.866, 3.867, 0.003, 0.002, -0.053, -0.055, -0.053, -0.055, -0.079, 0.003, 0.004, -0.079, 0.025, -0.017, -0.017, 0.025 ]
[ [ 0.00417052, -0.0005571, -0.00148304 ], [ 0.00357293, -0.00333908, -0.00150559 ], [ -0.02610619, 0.00065967, 0.02584467 ], [ -0.0308965, 0.01193997, 0.00334221 ], [ 0.03022508, -0.00973118, -0.00120574 ], [ 0.02538915, 0.00592366, -0.02633602 ], [ 0.00063208, -0.00840999, -0.01231789 ], [ 0.00622083, -0.00714637, 0.02402346 ], [ 0.00194461, 0.01114288, 0.00508669 ], [ 0.00026845, -0.00770971, -0.00270529 ], [ -0.00254464, -0.00706238, 0.00488052 ], [ -0.00070911, 0.00095459, -0.00468813 ], [ 0.00684462, 0.01459105, -0.00065254 ], [ 0.00362464, 0.00619557, -0.00693666 ], [ -0.01176008, -0.01352791, -0.00006016 ], [ -0.01297586, -0.00317522, 0.00415655 ], [ 0.00214957, 0.02243888, 0.01547452 ], [ 0.01244364, 0.03208994, 0.01829412 ], [ -0.01210926, -0.02198969, -0.02293643 ], [ 0.00055682, -0.02402438, -0.01311337 ], [ 0.00912787, 0.02684861, 0.01622258 ], [ 0.01215566, 0.02200285, 0.01455782 ], [ -0.01301103, -0.02297345, -0.02068998 ], [ -0.0092138, -0.02514119, -0.01725228 ] ]
-1.806
4.359226
pbe
true
bf0736504e6be76227d50e9f31ffb74f_2_Li6Mn4Sn2O12
[ "Mn", "Os", "Ta" ]
4
A2BC
MnOs2Ta
Ta1 Mn1 Os2
3
[ 1, 1, 1 ]
3
[ [ 3.15702195, 0, 0 ], [ 0, 3.15702195, 0 ], [ 0, 0, 6.0383192 ] ]
agm003183062
[ [ 1.578510975, 1.578510975, 4.5287394 ], [ 0, 0, 5.9727639460724316 ], [ 0, 0, 3.084714853927568 ], [ 1.578510975, 1.578510975, 1.5095798 ] ]
[{"mass": null, "name": "Ta", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ta"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Os", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Os"]}]
[ "Mn", "Os", "Os", "Ta" ]
2023-11-16 06:57:59
[ 0.25, 0.5, 0.25 ]
[ [ 6.9580326, 0, 0 ], [ 0, 6.9580326, 0 ], [ 0, 0, 6.779583 ] ]
-43.985985
[ 3.288, 0.154, 0.154, 0.113 ]
[ [ 0, 0, 0 ], [ 0, 0, 0.00123366 ], [ 0, 0, -0.00123366 ], [ 0, 0, 0 ] ]
3.868693
2.862421
pbe
true
d42f4aaac028782afc29122f6fe1889f_123_Ta1Mn1Os2
[ "Li", "Nb", "O", "P" ]
36
A12B4CD
LiNbO12P4
Li2 Nb2 O24 P8
4
[ 1, 1, 1 ]
3
[ [ 6.99252724, -0.00262941, 2.49651853 ], [ -3.12003763, 6.64075595, 1.13744205 ], [ -0.01375596, -0.02367492, 10.00112983 ] ]
mp-26767
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[{"mass": null, "name": "Li", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Li"]}, {"mass": null, "name": "Nb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nb"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "P", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["P"]}]
[ "Li", "Li", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "P", "P", "P", "P", "P", "P", "P", "P", "Nb", "Nb" ]
2019-08-23 22:41:25
[ 0.05555555555555555, 0.05555555555555555, 0.6666666666666666, 0.2222222222222222 ]
[ [ -0.2484975, -0.01718827, 0.03949074 ], [ -0.01719034, -0.09286852, -0.25209457 ], [ 0.03949451, -0.25209678, 0.17751333 ] ]
-260.894616
[]
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null
4.849996
pbe
true
b7771f49689de4d8cd02bcb580e5aa6e_15_Li2Nb2P8O24
[ "Li", "Ni", "O", "P" ]
28
A4BCD
LiNiO4P
Li4 Ni4 P4 O16
4
[ 1, 1, 1 ]
3
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agm005249275
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2023-11-16 06:57:59
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7.894336
0
pbe
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a4f9f4a996232e42ccb7b64b9302a3f9_2_Li4Ni4P4O16
[ "Li", "Ni", "O", "Si" ]
44
A10B9C2D
Li9NiO10Si2
Li18 Ni2 O20 Si4
4
[ 1, 1, 1 ]
3
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mp-1176868
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2019-01-11 06:28:45
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3.622
0.270053
pbe
true
5295e540fc3594527326969d5df252dc_1_Li18Si4Ni2O20
[ "Cd", "P", "Tl" ]
4
A2BC
CdPTl2
Tl2 Cd1 P1
3
[ 1, 1, 1 ]
3
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agm004419766
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[ "Cd", "P", "Tl", "Tl" ]
2023-11-16 06:57:59
[ 0.25, 0.25, 0.5 ]
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-10.333426
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-0
1.717062
pbe
true
e0b2550f3712f16b38cb949e923d19ad_6_Tl2Cd1P1
[ "Cd", "Pm", "S" ]
4
A2BC
CdPm2S
Pm2 Cd1 S1
3
[ 1, 1, 1 ]
3
[ [ 3.95254438, 0, 0 ], [ 1.97627219, 3.42300384, 0 ], [ 1.97627219, 1.14100128, 8.07460959 ] ]
agm005108887
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[{"mass": null, "name": "Cd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cd"]}, {"mass": null, "name": "S", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["S"]}, {"mass": null, "name": "Pm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pm"]}]
[ "Pm", "Pm", "Cd", "S" ]
2023-11-16 06:57:59
[ 0.25, 0.5, 0.25 ]
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-18.777598
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-0.000001
2.678167
pbe
true
b33b539ca5feca012653902e99448f32_160_Pm2Cd1S1
[ "Ni", "Rb", "Sc", "Se" ]
12
A3BCD
NiRbScSe3
Ni1 Rb1 Sc1 Se3
4
[ 1, 1, 1 ]
3
[ [ 1.950427, -7.689725, 0 ], [ 1.950427, 7.689725, 0 ], [ 0, 0, 10.242514 ] ]
oqmd-4597834
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[{"mass": null, "name": "Ni", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ni"]}, {"mass": null, "name": "Rb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Rb"]}, {"mass": null, "name": "Sc", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sc"]}, {"mass": null, "name": "Se", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Se"]}]
[ "Ni", "Ni", "Rb", "Rb", "Sc", "Sc", "Se", "Se", "Se", "Se", "Se", "Se" ]
2024-11-01 00:00:00
[ 0.16666666666666666, 0.16666666666666666, 0.16666666666666666, 0.5 ]
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-59.9858
[ 0.88, 0.876, 0.006, 0.006, 0.005, 0.005, 0.107, 0.142, 0.106, 0.106, 0.141, 0.106 ]
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3.01001
null
pbe
true
8d44ca4882ebb703f8f73bed05ca64a2_63_Rb2Sc2Ni2Se6
[ "O", "P", "Pb", "Ti" ]
35
A24B6C4D
O24P6PbTi4
Ti4 P6 Pb1 O24
4
[ 1, 1, 1 ]
3
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agm003242789
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2023-11-16 06:57:59
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0
0
pbe
true
0bb161e0a3071c0af8c3b9cb24b70653_148_Ti4P6Pb1O24
[ "Mg", "Pt", "Si", "Sr" ]
5
A2BCD
MgPt2SiSr
Sr1 Mg1 Si1 Pt2
4
[ 1, 1, 1 ]
3
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agm005017827
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[ "Sr", "Mg", "Si", "Pt", "Pt" ]
2023-11-16 06:57:59
[ 0.2, 0.4, 0.2, 0.2 ]
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-0
2.175528
pbe
true
3697cb5d830f1a80538000626ea2b23d_119_Sr1Mg1Si1Pt2
[ "Ag", "Sb" ]
36
A17B
Ag17Sb
Ag17 Sb1
2
[ 1, 1, 1 ]
3
[ [ 5.79981451, 0, 0 ], [ -2.899907255, 5.022786703, 0 ], [ 0, 0, 32.500962296 ] ]
oqmd-9751177
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[{"mass": null, "name": "Ag", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ag"]}, {"mass": null, "name": "Sb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sb"]}]
[ "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Ag", "Sb", "Sb" ]
2024-11-01 00:00:00
[ 0.9444444444444444, 0.05555555555555555 ]
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-102.528
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null
null
pbe
true
74ceccac1050bc7b142da33e932264f1_164_Ag34Sb2
[ "Mg", "Pt", "Sn", "Sr" ]
5
A2BCD
Mg2PtSnSr
Mg2 Pt1 Sn1 Sr1
4
[ 1, 1, 1 ]
3
[ [ -2.261867235, 2.261867235, 6.063002209 ], [ 2.261867235, -2.261867235, 6.063002209 ], [ 2.261867235, 2.261867235, -6.063002209 ] ]
oqmd-6492414
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[ "Mg", "Mg", "Pt", "Sn", "Sr" ]
2024-11-01 00:00:00
[ 0.4, 0.2, 0.2, 0.2 ]
[ [ 8.29069405, 0, 0 ], [ 0, 8.29069405, 0 ], [ 0, 0, 2.01280043 ] ]
-17.8979
[ 0, 0, 0, 0, 0 ]
[ [ 0, 0, -0.014503 ], [ 0, 0, -0.014503 ], [ 0, 0, -0.000824 ], [ 0, 0, 0.031825 ], [ 0, 0, -0.001995 ] ]
-0.005315
null
pbe
true
fa09af3f646d9d1f2dd0abd0d163277b_107_Sr1Mg2Sn1Pt1
[ "Cd", "Pr", "Sn" ]
4
A2BC
CdPrSn2
Pr1 Cd1 Sn2
3
[ 1, 1, 1 ]
3
[ [ 5.34232415, 0, 0 ], [ 2.67116208, 4.62658843, 0 ], [ 2.67116208, 1.54219614, 7.38872421 ] ]
agm001937482
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[{"mass": null, "name": "Cd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cd"]}, {"mass": null, "name": "Sn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sn"]}, {"mass": null, "name": "Pr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pr"]}]
[ "Pr", "Sn", "Sn", "Cd" ]
2023-11-16 06:57:59
[ 0.25, 0.25, 0.5 ]
[ [ 2.0752192, 0, 0 ], [ 0, 2.0752192, 0 ], [ 0, 0, 2.3608718 ] ]
-12.942674
[ 0, 0, 0, 0 ]
[ [ 0, 0, 0 ], [ 0, 0, -0.0025324 ], [ 0, 0, 0.0025324 ], [ 0, 0, 0 ] ]
0
3.529321
pbe
true
d769c34bd5b335c673637b0cae04e7d8_166_Pr1Cd1Sn2
[ "As", "Co" ]
4
AB
AsCo
Co2 As2
2
[ 1, 1, 1 ]
3
[ [ 4.40399315, 0.02480339, -0.01063577 ], [ 3.5092564, 4.22800387, -0.01517265 ], [ 1.12211518, 0.24201477, 2.91818258 ] ]
agm004088613
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[{"mass": null, "name": "As", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["As"]}, {"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}]
[ "As", "As", "Co", "Co" ]
2023-11-16 06:57:59
[ 0.5, 0.5 ]
[ [ 1.5846221, -0.10863522, -0.12270221 ], [ -0.10863568, 1.4850717, 0.02162192 ], [ -0.12270217, 0.02162174, 1.2874799 ] ]
-23.629002
[ 0, 0, 0.001, 0.001 ]
[ [ 0.00021633, 0.00145531, -0.00020388 ], [ -0.00021633, -0.00145531, 0.00020388 ], [ -0.00187429, -0.0008184, 0.00078858 ], [ 0.00187429, 0.0008184, -0.00078858 ] ]
0.001095
3.592835
pbe
true
e80654e416201c802dbb3fa61303655b_12_Co2As2
[ "Cd", "Pr", "Tc" ]
4
A2BC
CdPr2Tc
Pr2 Cd1 Tc1
3
[ 1, 1, 1 ]
3
[ [ 3.60830902, 0, 0 ], [ 0, 3.60830902, 0 ], [ 0, 0, 8.01554083 ] ]
agm001126071
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[{"mass": null, "name": "Cd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cd"]}, {"mass": null, "name": "Tc", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tc"]}, {"mass": null, "name": "Pr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pr"]}]
[ "Pr", "Pr", "Tc", "Cd" ]
2023-11-16 06:57:59
[ 0.25, 0.5, 0.25 ]
[ [ 2.258189, 0, 0 ], [ 0, 2.258189, 0 ], [ 0, 0, 2.367008 ] ]
-20.948044
[ 0, 0, 0, 0 ]
[ [ 0, 0, 0.00347018 ], [ 0, 0, -0.00347018 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
0.000004
3.400307
pbe
true
f92360b1f3f1fa81486485521f75c8bf_123_Pr2Cd1Tc1
[ "Cd", "Pr", "U" ]
3
ABC
CdPrU
Cd1 Pr1 U1
3
[ 1, 1, 1 ]
3
[ [ 0, 3.587800685, 3.587800685 ], [ 3.587800685, 0, 3.587800685 ], [ 3.587800685, 3.587800685, 0 ] ]
oqmd-6992219
[ [ 0, 0, 0 ], [ 3.5878000000000005, 3.5878000000000005, 3.5878000000000005 ], [ 1.7939000000000005, 1.7939000000000005, 1.7939000000000005 ] ]
[{"mass": null, "name": "Cd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cd"]}, {"mass": null, "name": "Pr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pr"]}, {"mass": null, "name": "U", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["U"]}]
[ "Cd", "Pr", "U" ]
2024-11-01 00:00:00
[ 0.3333333333333333, 0.3333333333333333, 0.3333333333333333 ]
[ [ 7.32701435, 0, 0 ], [ 0, 7.32701435, 0 ], [ 0, 0, 7.32701435 ] ]
-14.1214
[ -0.011, 0.3, 2.651 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
3.20966
null
pbe
true
c77f974fa974bd72fe84702b48f18123_216_Pr1U1Cd1
[ "As", "La" ]
8
AB
AsLa
La4 As4
2
[ 1, 1, 1 ]
3
[ [ 7.72312352, 0.72809633, 0 ], [ 0.71577432, 7.72467539, 0 ], [ 0, 0, 16.58967601 ] ]
agm2000011015
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[{"mass": null, "name": "As", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["As"]}, {"mass": null, "name": "La", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["La"]}]
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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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1f62917e968824fb3aa992fe44d3f86e_216_Rb1Ta1Cd1
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AB
AsRu
As2 Ru2
2
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2023-11-16 06:57:59
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A2B
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2023-11-16 06:57:59
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e10435ee47af23405cf3817717198ed2_65_Sb2As1
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A2BC
CdReRu2
Cd1 Re1 Ru2
3
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2023-11-16 06:57:59
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AB
AuP
P6 Au6
2
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3
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2023-11-16 06:57:59
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pbe
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c6e713566344294a530104cf0600c53c_164_P6Au6
[ "Ni", "Ta", "Ti" ]
12
ABC
NiTaTi
Ta4 Ti4 Ni4
3
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3
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2023-11-16 06:57:59
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dfae6c839efcb2baf12309c8052a4820_70_Ta4Ti4Ni4
[ "Mg", "S", "Si", "Zn" ]
20
A6B2CD
MgS6Si2Zn
Mg2 Zn2 Si4 S12
4
[ 1, 1, 1 ]
3
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2023-11-16 06:57:59
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b2c540fd1d61f70c2fb00695be29ee7f_15_Mg2Zn2Si4S12
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A8B
Os8Sb
Sb1 Os8
2
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2023-11-16 06:57:59
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976fec392fe910329daa8065a27a2632_139_Sb1Os8
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AuPt3
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2023-11-16 06:57:59
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47fc2881b49a989f675b937c88e64a2a_166_Pt3Au1
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A2BCD
MgSn2SrZn
Sr1 Mg1 Zn1 Sn2
4
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2023-11-16 06:57:59
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c8d80fbf4c24cbc2dae1c97abeb7f73b_119_Sr1Mg1Zn1Sn2
[ "Os", "Sc" ]
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A3B2
Os2Sc3
Sc3 Os2
2
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[ "Sc", "Sc", "Sc", "Os", "Os" ]
2023-11-16 06:57:59
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0.000007
6.104189
pbe
true
0069ab07ca11e1ea91e82d29569aa165_166_Sc3Os2
[ "Os", "Se" ]
4
AB
OsSe
Os2 Se2
2
[ 1, 1, 1 ]
3
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agm003928930
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[ "Os", "Os", "Se", "Se" ]
2023-11-16 06:57:59
[ 0.5, 0.5 ]
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0.000003
1.422759
pbe
true
6138dbe4d5806df41216c0a73b3cdd8f_129_Os2Se2
[ "Ge", "Ta", "Ti" ]
10
A2B2C
Ge2TaTi2
Ta2 Ti4 Ge4
3
[ 1, 1, 1 ]
3
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agm003023015
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[ "Ge", "Ge", "Ge", "Ge", "Ti", "Ti", "Ti", "Ti", "Ta", "Ta" ]
2023-11-16 06:57:59
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0
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true
d2ed7036d4c170132f69327bc9ba4b89_127_Ta2Ti4Ge4
[ "Ge", "Ta", "V" ]
10
A2B2C
Ge2Ta2V
Ta4 V2 Ge4
3
[ 1, 1, 1 ]
3
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agm003393362
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[ "Ta", "Ta", "Ta", "Ta", "V", "V", "Ge", "Ge", "Ge", "Ge" ]
2023-11-16 06:57:59
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0619741b610a4bb403a983e5c8f775ee_36_Ta4V2Ge4
[ "Mn", "Mo", "Na", "O" ]
60
A47B8C4D
MnMo8Na4O47
Mn1 Mo8 Na4 O47
4
[ 1, 1, 1 ]
3
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mp-1224580
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[ "Na", "Na", "Na", "Na", "Mn", "Mo", "Mo", "Mo", "Mo", "Mo", "Mo", "Mo", "Mo", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2019-01-13 00:48:42
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-356.812001
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7.76
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pbe
true
69623de1eff5f141f370daa6cb420ffa_2_Na4Mn1Mo8O47
[ "Np", "Pr", "Si" ]
3
ABC
NpPrSi
Np1 Pr1 Si1
3
[ 1, 1, 1 ]
3
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oqmd-6981137
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[ "Np", "Pr", "Si" ]
2024-11-01 00:00:00
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-20.8088
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5.65095
null
pbe
true
b5506afa987860ca58c46fac565572ca_216_Pr1Np1Si1
[ "Mn", "Mo", "O", "Zn" ]
58
A45B9C3D
MnMo9O45Zn3
Mn1 Mo9 O45 Zn3
4
[ 1, 1, 1 ]
3
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mp-1222690
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[{"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Mo", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mo"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "Zn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zn"]}]
[ "Mn", "Zn", "Zn", "Zn", "Mo", "Mo", "Mo", "Mo", "Mo", "Mo", "Mo", "Mo", "Mo", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2019-01-12 23:11:25
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-331.739132
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24.79
-1.036125
pbe
true
5440c1a1c7d0acad72a620ff27537e35_1_Mn1Zn3Mo9O45
[ "Mn", "N", "Nd", "Pa" ]
20
A12B4C3D
Mn4N12NdPa3
Nd1 Pa3 Mn4 N12
4
[ 1, 1, 1 ]
3
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agm004709029
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[ "Nd", "Pa", "Pa", "Pa", "Mn", "Mn", "Mn", "Mn", "N", "N", "N", "N", "N", "N", "N", "N", "N", "N", "N", "N" ]
2023-11-16 06:57:59
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-181.559903
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9.952679
7.338224
pbe
true
0fd6e2ed99f4435cf35a4a362dd067e5_155_Nd1Pa3Mn4N12
[ "O", "Pa", "Pt" ]
3
ABC
OPaPt
Pa1 Pt1 O1
3
[ 1, 1, 1 ]
3
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agm001828954
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[ "Pa", "O", "Pt" ]
2023-11-16 06:57:59
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0.000833
2.759148
pbe
true
c0582b6ca6792d3ec36f2335fd5aac6a_107_Pa1Pt1O1
[ "O", "Pm", "Y" ]
3
ABC
OPmY
Pm1 Y1 O1
3
[ 1, 1, 1 ]
3
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agm001259940
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[ "Y", "O", "Pm" ]
2023-11-16 06:57:59
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-21.454828
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0.049198
1.804291
pbe
true
e7b94981de01702bf3c48e9ef139805d_156_Pm1Y1O1
[ "Mn", "N", "Pa", "Pr" ]
20
A12B4C3D
Mn4N12Pa3Pr
Pr1 Pa3 Mn4 N12
4
[ 1, 1, 1 ]
3
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agm004709031
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[{"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Pa", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pa"]}, {"mass": null, "name": "Pr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pr"]}, {"mass": null, "name": "N", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["N"]}]
[ "Pr", "Pa", "Pa", "Pa", "Mn", "Mn", "Mn", "Mn", "N", "N", "N", "N", "N", "N", "N", "N", "N", "N", "N", "N" ]
2023-11-16 06:57:59
[ 0.2, 0.6, 0.15, 0.05 ]
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-181.609335
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9.949108
7.259242
pbe
true
b58de9c3ded56722034f2ed204c455c0_155_Pr1Pa3Mn4N12
[ "Be", "Mn", "Sc" ]
10
A2B2C
Be2Mn2Sc
Sc2 Mn4 Be4
3
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3
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agm002961693
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2023-11-16 06:57:59
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pbe
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145cda708039d615d9b65a497a2b14cf_127_Sc2Mn4Be4
[ "Ba", "Mg" ]
5
A3B2
Ba2Mg3
Ba2 Mg3
2
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3
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agm005419311
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[ "Ba", "Ba", "Mg", "Mg", "Mg" ]
2023-11-16 06:57:59
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pbe
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920d71d0a5c8471b964f29ef6743ee73_164_Ba2Mg3
[ "Mn", "N", "Pa", "Sm" ]
20
A12B4C3D
Mn4N12Pa3Sm
Sm1 Pa3 Mn4 N12
4
[ 1, 1, 1 ]
3
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2023-11-16 06:57:59
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9.958278
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pbe
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f8b38c915856c9b97b6cc32dc9d5a18c_155_Sm1Pa3Mn4N12
[ "Mn", "N", "Pa", "Sn" ]
20
A12B4C3D
Mn4N12Pa3Sn
Pa3 Mn4 Sn1 N12
4
[ 1, 1, 1 ]
3
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2023-11-16 06:57:59
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8.970562
4.634066
pbe
true
ab7e6f8aa02e139c7e63e7f3de2ee7b7_155_Pa3Mn4Sn1N12
[ "Bi", "Rh" ]
5
A4B
BiRh4
Bi1 Rh4
2
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3
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agm006186658
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[ "Rh", "Rh", "Rh", "Rh", "Bi" ]
2023-11-16 06:57:59
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2.926367
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pbe
true
93739f053132b282958f2beddb5be533_221_Bi1Rh4
[ "Mn", "N", "Pa", "Tb" ]
20
A12B4C3D
Mn4N12Pa3Tb
Tb1 Pa3 Mn4 N12
4
[ 1, 1, 1 ]
3
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agm004709039
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2023-11-16 06:57:59
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9.963654
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pbe
true
0dfa5e05736aeec7fec80f0c96c63342_155_Tb1Pa3Mn4N12
[ "Be", "Mo", "Pt" ]
4
A2BC
BeMo2Pt
Be1 Mo2 Pt1
3
[ 1, 1, 1 ]
3
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agm003848097
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[ "Be", "Mo", "Mo", "Pt" ]
2023-11-16 06:57:59
[ 0.25, 0.5, 0.25 ]
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0.000001
2.411646
pbe
true
1f8500cd0b1d27781c6432e52aeccd0d_65_Be1Mo2Pt1
[ "Mn", "N", "Pa", "Tl" ]
20
A12B4C3D
Mn4N12Pa3Tl
Pa3 Mn4 Tl1 N12
4
[ 1, 1, 1 ]
3
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agm004708935
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[ "Pa", "Pa", "Pa", "Mn", "Mn", "Mn", "Mn", "Tl", "N", "N", "N", "N", "N", "N", "N", "N", "N", "N", "N", "N" ]
2023-11-16 06:57:59
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[{"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Na", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Na"]}, {"mass": null, "name": "P", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["P"]}]
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2023-11-16 06:57:59
[ 0.11538461538461539, 0.15384615384615385, 0.5769230769230769, 0.15384615384615385 ]
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-722.5078
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60.000004
0
pbe
true
d1b508bb271bb432c1b05bfe0459084c_33_Na16Mn12P16O60
[ "Be", "Mo", "Se" ]
4
A2BC
BeMoSe2
Be1 Mo1 Se2
3
[ 1, 1, 1 ]
3
[ [ 3.44437987, -0.01877331, 0 ], [ -1.94226713, 2.84459198, 0 ], [ 0, 0, 7.26159485 ] ]
agm004122298
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[{"mass": null, "name": "Mo", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mo"]}, {"mass": null, "name": "Be", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Be"]}, {"mass": null, "name": "Se", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Se"]}]
[ "Be", "Mo", "Se", "Se" ]
2023-11-16 06:57:59
[ 0.25, 0.25, 0.5 ]
[ [ 0.34097332, -0.21843334, 0 ], [ -0.21843334, 0.04616213, 0 ], [ 0, 0, 0.38125852 ] ]
-19.961982
[ 0, 0.601, 0.003, 0.003 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0.00179835 ], [ 0, 0, -0.00179835 ] ]
0.705046
3.104981
pbe
true
00b01db1288e5fb01088d9371694692d_65_Be1Mo1Se2
[ "Be", "Mo", "Sr" ]
4
A2BC
Be2MoSr
Sr1 Be2 Mo1
3
[ 1, 1, 1 ]
3
[ [ 7.30435152, 0.00552335, 0.00973775 ], [ -3.1238615, 3.63922255, -0.00305694 ], [ 1.0550497, 0.92334866, 2.4123731 ] ]
agm004065206
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[{"mass": null, "name": "Mo", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mo"]}, {"mass": null, "name": "Be", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Be"]}, {"mass": null, "name": "Sr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sr"]}]
[ "Sr", "Mo", "Be", "Be" ]
2023-11-16 06:57:59
[ 0.5, 0.25, 0.25 ]
[ [ 0.30506212, 0.25436872, 0.17529592 ], [ 0.25436875, -0.09166773, 0.38372853 ], [ 0.17529623, 0.38372865, 0.06724298 ] ]
-16.919772
[ 0, 0, 0, 0 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
0.000019
1.524702
pbe
true
236957b6fa48a98ad67cfa8fa1605030_123_Sr1Be2Mo1
[ "Mn", "Na", "O", "Se" ]
20
A12B4C3D
Mn3NaO12Se4
Na1 Mn3 Se4 O12
4
[ 1, 1, 1 ]
3
[ [ 6.71798593, -0.05974712, -0.08300506 ], [ -1.67664086, 6.50567291, -0.08300506 ], [ -1.67664086, -2.14377362, 6.14287429 ] ]
agm004707424
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[{"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Se", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Se"]}, {"mass": null, "name": "Na", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Na"]}]
[ "Na", "Mn", "Mn", "Mn", "Se", "Se", "Se", "Se", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2023-11-16 06:57:59
[ 0.15, 0.05, 0.6, 0.2 ]
[ [ 1.0782965, 0.08318858, 0.11557166 ], [ 0.08318858, 1.1196009, 0.14777134 ], [ 0.11557166, 0.14777134, 1.2185297 ] ]
-113.672576
[ 0.002, 4.103, 4.103, 4.103, 0.023, 0.023, 0.023, 0.087, -0.109, -0.002, -0.002, -0.002, -0.015, -0.015, -0.015, -0.015, -0.015, -0.015, -0.109, -0.109 ]
[ [ 0, 0, 0 ], [ -0.0021494, 0.00168104, 0 ], [ 0.0021494, 0.0005336, -0.0015941 ], [ 0, -0.00221464, 0.0015941 ], [ 0.00107257, -0.00083886, 0 ], [ -0.00107257, -0.00026627, 0.00079548 ], [ 0, 0.00110513, -0.00079548 ], [ 0, 0, 0 ], [ 0, 0.00511844, -0.00368426 ], [ 0.00359817, 0.00089327, -0.00266858 ], [ -0.00359817, 0.00281412, 0 ], [ 0, -0.00370739, 0.00266858 ], [ -0.00164721, -0.00311681, 0.00260712 ], [ 0.00375654, -0.00076462, -0.00212806 ], [ -0.0026281, 0.00321813, -0.00140057 ], [ 0.00164721, -0.00346164, 0.00212806 ], [ 0.0026281, 0.00234966, -0.00260712 ], [ -0.00375654, 0.00177529, 0.00140057 ], [ -0.00496765, -0.00123325, 0.00368426 ], [ 0.00496765, -0.00388519, 0 ] ]
12.441769
5.900028
pbe
true
05b226efe78f5831763e5702284e8447_155_Na1Mn3Se4O12
[ "Mn", "Na", "O", "Si" ]
66
A36B13C12D5
Mn5Na13O36Si12
Mn5 Na13 O36 Si12
4
[ 1, 1, 1 ]
3
[ [ 0, -7.49411502, 0.04401335 ], [ -10.39847348, 0, 0 ], [ 0, 0.06163891, -10.41963386 ] ]
mp-1221917
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[{"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Na", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Na"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "Si", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Si"]}]
[ "Na", "Na", "Na", "Na", "Na", "Na", "Na", "Na", "Na", "Na", "Na", "Na", "Na", "Mn", "Mn", "Mn", "Mn", "Mn", "Si", "Si", "Si", "Si", "Si", "Si", "Si", "Si", "Si", "Si", "Si", "Si", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2019-01-12 22:32:04
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23
3.092665
pbe
true
7302c2880e3c794374af6d19bf454e28_6_Na13Mn5Si12O36
[ "Mn", "Na", "Se", "Sn" ]
20
A6B2CD
MnNaSe6Sn2
Na2 Mn2 Sn4 Se12
4
[ 1, 1, 1 ]
3
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agm004979194
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2023-11-16 06:57:59
[ 0.1, 0.1, 0.6, 0.2 ]
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8.010354
1.496628
pbe
true
e85ec49f93143a642380aa180ad5ee21_15_Na2Mn2Sn4Se12
[ "Be", "Mo", "Y" ]
4
A2BC
BeMo2Y
Y1 Be1 Mo2
3
[ 1, 1, 1 ]
3
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agm004300017
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[ "Y", "Be", "Mo", "Mo" ]
2023-11-16 06:57:59
[ 0.25, 0.5, 0.25 ]
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-30.208325
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3.246528
pbe
true
742d4396ebacf00b15cbda8a9eaf0065_10_Y1Be1Mo2
[ "Co", "Te" ]
4
AB
CoTe
Co2 Te2
2
[ 1, 1, 1 ]
3
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agm2000002997
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[{"mass": null, "name": "Co", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Co"]}, {"mass": null, "name": "Te", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Te"]}]
[ "Te", "Te", "Co", "Co" ]
2023-11-16 06:57:59
[ 0.5, 0.5 ]
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-19.416679
[ -0.025, -0.025, 0.378, 0.378 ]
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0.689467
3.02594
pbe
true
3f07d4531818bc97279b761a1063bef0_187_Co2Te2
[ "Cd", "Ru", "Te" ]
4
A2BC
CdRuTe2
Cd1 Te2 Ru1
3
[ 1, 1, 1 ]
3
[ [ 3.98892174, 0, 0 ], [ 0, 5.81956726, 0.00415196 ], [ 0, 3.37364437, 4.73383527 ] ]
agm004063330
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[{"mass": null, "name": "Cd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cd"]}, {"mass": null, "name": "Ru", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ru"]}, {"mass": null, "name": "Te", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Te"]}]
[ "Cd", "Ru", "Te", "Te" ]
2023-11-16 06:57:59
[ 0.25, 0.25, 0.5 ]
[ [ 2.4731104, 0, 0 ], [ 0, 2.2756152, 0.1349899 ], [ 0, 0.13498999, 2.4311185 ] ]
-16.417913
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0.000005
2.810618
pbe
true
c35dd647ba9209534d731f2980479e2f_65_Cd1Te2Ru1
[ "Cr", "Ni" ]
4
AB
CrNi
Cr2 Ni2
2
[ 1, 1, 1 ]
3
[ [ 2.44048221, 0, 0.22202028 ], [ 0, 4.04283997, 0 ], [ -0.41052611, 0, 4.45997882 ] ]
agm002145467
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[{"mass": null, "name": "Cr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cr"]}, {"mass": null, "name": "Ni", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ni"]}]
[ "Ni", "Ni", "Cr", "Cr" ]
2023-11-16 06:57:59
[ 0.5, 0.5 ]
[ [ -1.4020449, 0, 0.50810903 ], [ 0, -3.3907378, 0 ], [ 0.50810546, 0, -8.240674 ] ]
-30.703618
[ 0.001, -0.001, 0, 0 ]
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0
5.116028
pbe
true
9bab06552c2f3d336ad2611f432935d0_51_Cr2Ni2
[ "Cu", "In" ]
5
A4B
CuIn4
In4 Cu1
2
[ 1, 1, 1 ]
3
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agm006183786
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[{"mass": null, "name": "In", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["In"]}, {"mass": null, "name": "Cu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cu"]}]
[ "Cu", "In", "In", "In", "In" ]
2023-11-16 06:57:59
[ 0.2, 0.8 ]
[ [ -1.4985142, 0, 0 ], [ 0, -1.4985142, 0 ], [ 0, 0, -1.4985142 ] ]
-14.333882
[ 0, 0, 0, 0, 0 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
-0.00001
2.617235
pbe
true
85bb4b0fe9ed51259477a539f422a70f_221_In4Cu1
[ "Mn", "Nb", "Nd", "Si" ]
5
A2BCD
MnNbNdSi2
Nd1 Mn1 Nb1 Si2
4
[ 1, 1, 1 ]
3
[ [ 4.02342741, 0, 0 ], [ 0, 4.02342741, 0 ], [ -2.01171371, -2.0117137, 5.66591161 ] ]
agm005019377
[ [ 0, 0, 0 ], [ 2.0117137025, 2.4999999848063226e-9, 2.832955805 ], [ -2.4999999848063226e-9, 2.0117137075000002, 2.832955805 ], [ 2.0117136837839555, 2.0117136859817704, 1.2452622692176345 ], [ 1.6216044432088618e-8, 2.4018229884671062e-8, 4.420649340782365 ] ]
[{"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Nd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nd"]}, {"mass": null, "name": "Si", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Si"]}, {"mass": null, "name": "Nb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nb"]}]
[ "Nd", "Mn", "Nb", "Si", "Si" ]
2023-11-16 06:57:59
[ 0.2, 0.2, 0.2, 0.4 ]
[ [ 1.2913674, 0, 0 ], [ 0, 1.2913674, 0 ], [ 0, 0, 1.7339869 ] ]
-37.528243
[ -0.096, 2.353, -0.408, -0.024, -0.024 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0.00003684 ], [ 0, 0, -0.00003684 ] ]
1.649329
4.110167
pbe
true
fd3ccb990dab0e79e76fee75d3f4868a_119_Nd1Mn1Nb1Si2
[ "Cd", "Sc", "Y" ]
4
A2BC
CdSc2Y
Y1 Sc2 Cd1
3
[ 1, 1, 1 ]
3
[ [ 4.67426236, 0, 0 ], [ 0, 4.62383822, 0 ], [ 0, 0, 4.62383822 ] ]
agm001223237
[ [ 2.33713118, 2.31191911, 2.31191911 ], [ 0, 0, 2.31191911 ], [ 0, 2.31191911, 0 ], [ 2.33713118, 0, 0 ] ]
[{"mass": null, "name": "Cd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cd"]}, {"mass": null, "name": "Sc", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sc"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}]
[ "Y", "Sc", "Sc", "Cd" ]
2023-11-16 06:57:59
[ 0.25, 0.5, 0.25 ]
[ [ 3.4550252, 0, 0 ], [ 0, 3.4239674, 0 ], [ 0, 0, 3.4239674 ] ]
-20.437175
[ 0.116, 0.189, 0.189, -0.005 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
0.732688
5.415091
pbe
true
98a0c11ba3b4ff19405e9ab9f8cd7eb9_123_Y1Sc2Cd1
[ "Mn", "Nb", "O", "Sr" ]
20
A6B2CD
MnNbO6Sr2
Mn2 Nb2 O12 Sr4
4
[ 1, 1, 1 ]
3
[ [ -3.9601683, -4.06322072, 0.01966959 ], [ -0.00155644, 4.08543982, -4.0853755 ], [ 3.9748687, -4.03861309, -8.12404598 ] ]
mp-1281818
[ [ -1.9719357199529253, -2.037664443772194, -2.0224659569836123 ], [ 1.991892945378928, -2.0115883466776583, -6.113137825076237 ], [ -1.9783574392481758, -2.005231797943676, -6.078009501328544 ], [ 1.9850567734707445, -1.9786414589600154, -10.167378064579918 ], [ 0.0057405157745682445, 0.03360197819258648, -8.13726039855022 ], [ -3.960186895918944, 0.021929671054047133, -4.064170073845212 ], [ 0.00762255934498568, -0.047603324626511956, -3.998670690693174 ], [ 0.005969377049906299, -3.9686897709589077, -8.19109022025619 ], [ 0.045124766629844326, -0.18228864240326986, -1.9247076631197575 ], [ -0.08282073029588899, -3.8708734081579963, -6.252194917325979 ], [ -0.038214591633639605, -2.120439818128819, -3.8905836546960777 ], [ 0.07101612548357039, -5.9078620353284315, -8.308565706188697 ], [ -2.0018900888120847, -0.0976318216159453, -3.9875433812614784 ], [ 1.9557835895842623, 0.11286740369599979, -8.287979063654603 ], [ 0.09429355820920504, -0.1442125612064118, -5.938166590669159 ], [ -0.031322331138052384, -3.8344621060983393, -10.264321740748725 ], [ -0.058498778106300886, 1.8918754520306686, -3.880585553802592 ], [ 0.050531108643965705, -1.8961917166081994, -8.299650430198557 ], [ -1.9427027687165357, -4.129485767788178, -3.9026702326310923 ], [ 2.0152626444727533, -3.918211257603823, -8.201884949857222 ] ]
[{"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Nb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nb"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "Sr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sr"]}]
[ "Sr", "Sr", "Sr", "Sr", "Mn", "Mn", "Nb", "Nb", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2020-04-24 18:06:37
[ 0.1, 0.1, 0.6, 0.2 ]
[ [ 0.35151406, 0.0345962, 0.03248048 ], [ 0.03471183, -0.36536666, -0.02504345 ], [ 0.03534391, -0.0259694, -0.42342223 ] ]
-152.883538
[ 0, 0, 0, 0, -3.789, 3.79, 0, 0, -0.015, -0.041, 0.015, 0.041, -0.006, 0.007, -0.041, -0.015, 0.041, 0.015, 0.007, -0.007 ]
[ [ 0.00203937, -0.0007321, -0.00271431 ], [ -0.00150164, -0.00007155, 0.00378439 ], [ -0.002012, 0.00141265, -0.00026728 ], [ 0.00465348, -0.00061137, 0.00612535 ], [ 0.0009369, 0.01621803, -0.00430872 ], [ -0.02534944, 0.00202001, -0.02604251 ], [ -0.00257635, -0.00009503, -0.00440764 ], [ 0.00625452, -0.00905197, 0.01324681 ], [ -0.02838763, -0.00768177, -0.01688344 ], [ -0.01531007, -0.01558513, -0.01919469 ], [ 0.00907736, 0.0156045, -0.0107263 ], [ 0.01690319, 0.01561161, -0.00748096 ], [ 0.00850613, -0.01844519, -0.02447712 ], [ 0.00577424, -0.00735424, -0.02473087 ], [ 0.02072595, 0.0118727, 0.02739417 ], [ 0.03167839, 0.01166823, 0.01789337 ], [ -0.01279676, -0.02453656, 0.00920087 ], [ -0.00655798, -0.01387252, 0.0082413 ], [ -0.01366113, 0.00603538, 0.02289891 ], [ 0.00160346, 0.01759434, 0.03244866 ] ]
0.002
3.207865
pbe
true
6c5e8b0fea598a562056a47c6463a2ed_2_Sr4Mn2Nb2O12
[ "Be", "N", "Se" ]
5
A3BC
BeN3Se
Be1 Se1 N3
3
[ 1, 1, 1 ]
3
[ [ 3.54408411, 0, 0 ], [ 0, 3.54408411, 0 ], [ 0, 0, 3.54408411 ] ]
agm002419972
[ [ 0, 0, 0 ], [ 1.772042055, 1.772042055, 1.772042055 ], [ 0, 1.772042055, 0 ], [ 0, 0, 1.772042055 ], [ 1.772042055, 0, 0 ] ]
[{"mass": null, "name": "Se", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Se"]}, {"mass": null, "name": "Be", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Be"]}, {"mass": null, "name": "N", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["N"]}]
[ "Be", "Se", "N", "N", "N" ]
2023-11-16 06:57:59
[ 0.2, 0.6, 0.2 ]
[ [ 46.034554, 0, 0 ], [ 0, 46.034554, 0 ], [ 0, 0, 46.034554 ] ]
-23.28726
[ 0, 0, 0, 0, 0 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
0.000062
3.852647
pbe
true
03b646439c63567876c434a5e8b9e01b_221_Be1Se1N3
[ "Mn", "Nb", "O", "Zn" ]
24
A8B2CD
MnNb2O8Zn
Mn2 Nb4 Zn2 O16
4
[ 1, 1, 1 ]
3
[ [ 2.87511792, 9.88496349, 0.33530714 ], [ -2.87511792, 9.88496349, 0.33530714 ], [ 0, 0.521151, 5.05266351 ] ]
agm005285984
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[{"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Zn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zn"]}, {"mass": null, "name": "Nb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nb"]}]
[ "Mn", "Mn", "Nb", "Nb", "Nb", "Nb", "Zn", "Zn", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]
2023-11-16 06:57:59
[ 0.08333333333333333, 0.16666666666666666, 0.6666666666666666, 0.08333333333333333 ]
[ [ 0.9611735, 0, 0 ], [ 0, 1.0138606, 0.05459346 ], [ 0, 0.05459338, 0.8717053 ] ]
-184.834153
[ 3.163, 3.158, 0.025, 0.025, 0.031, 0.031, -0.001, -0.001, -0.032, -0.032, -0.031, -0.031, -0.082, -0.082, -0.074, -0.074, -0.012, -0.012, -0.004, -0.004, -0.006, -0.006, -0.028, -0.028 ]
[ [ -0.00158259, 0, 0 ], [ 0.00249175, 0, 0 ], [ -0.00137529, -0.00054159, -0.00085782 ], [ -0.00137529, 0.00054159, 0.00085782 ], [ 0.00111546, 0.00266904, -0.00195082 ], [ 0.00111546, -0.00266904, 0.00195082 ], [ -0.00070561, 0.00612659, -0.00136372 ], [ -0.00070561, -0.00612659, 0.00136372 ], [ 0.00023381, 0.00507094, -0.00218351 ], [ 0.00023381, -0.00507094, 0.00218351 ], [ 0.00147909, -0.00522123, 0.00000286 ], [ 0.00147909, 0.00522123, -0.00000286 ], [ -0.00341829, -0.0001863, 0.00112077 ], [ -0.00341829, 0.0001863, -0.00112077 ], [ -0.0001167, 0.00250994, 0.00112803 ], [ -0.0001167, -0.00250994, -0.00112803 ], [ -0.00045351, -0.00079798, 0.00081307 ], [ -0.00045351, 0.00079798, -0.00081307 ], [ 0.00359255, 0.0009444, 0.0022102 ], [ 0.00359255, -0.0009444, -0.0022102 ], [ -0.00184927, -0.00437373, 0.00123854 ], [ -0.00184927, 0.00437373, -0.00123854 ], [ 0.00104318, -0.00040222, -0.00516436 ], [ 0.00104318, 0.00040222, 0.00516436 ] ]
5.96572
-0.013506
pbe
true
ae06658388286608c235f82e0c096052_5_Mn2Nb4Zn2O16
[ "Mn", "Nb", "Pa", "Si" ]
5
A2BCD
MnNbPaSi2
Pa1 Mn1 Nb1 Si2
4
[ 1, 1, 1 ]
3
[ [ 3.95937785, 0, 0 ], [ 0, 3.95937785, 0 ], [ -1.97968893, -1.97968893, 5.5770108 ] ]
agm005019388
[ [ 0, 0, 0 ], [ 1.9796889225000003, -2.4999999848063226e-9, 2.7885054 ], [ -2.4999999848063226e-9, 1.9796889225000003, 2.7885054 ], [ 1.9796889239361868, 1.9796889239361868, 1.186579541116512 ], [ -3.936186851494677e-9, -3.936186851494677e-9, 4.390431258883488 ] ]
[{"mass": null, "name": "Mn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Mn"]}, {"mass": null, "name": "Pa", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pa"]}, {"mass": null, "name": "Si", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Si"]}, {"mass": null, "name": "Nb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nb"]}]
[ "Pa", "Mn", "Nb", "Si", "Si" ]
2023-11-16 06:57:59
[ 0.2, 0.2, 0.2, 0.4 ]
[ [ 1.9347144, 0, 0 ], [ 0, 1.9347144, 0 ], [ 0, 0, 1.8023912 ] ]
-41.949449
[ 0.092, 2.431, -0.217, -0.014, -0.014 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, -0.0030852 ], [ 0, 0, 0.0030852 ] ]
2.317433
5.263098
pbe
true
f92a9ca424fb0466edd76e16abca4082_119_Pa1Mn1Nb1Si2
[ "Cd", "Se", "Zn" ]
4
A2BC
CdSe2Zn
Cd1 Se2 Zn1
3
[ 1, 1, 1 ]
3
[ [ 4.20706882, 0, 0 ], [ 0, 4.20706882, 0 ], [ 0, 0, 6.02766651 ] ]
mp-1017534
[ [ 2.10353441, 2.10353441, 3.013833255 ], [ 0, 0, 0 ], [ 0, 2.10353441, 4.380323516646526 ], [ 2.10353441, 0, 1.6473429933534747 ] ]
[{"mass": null, "name": "Cd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cd"]}, {"mass": null, "name": "Se", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Se"]}, {"mass": null, "name": "Zn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zn"]}]
[ "Zn", "Cd", "Se", "Se" ]
2023-01-17 05:56:24
[ 0.25, 0.5, 0.25 ]
[ [ -0.48344153, 0, 0 ], [ 0, -0.48344153, 0 ], [ 0, 0, -0.19882624 ] ]
-11.789865
[ 0, 0, 0, 0 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0.002041 ], [ 0, 0, -0.002041 ] ]
0
0.960205
pbe
true
c8cc3c5ea4bf5bf00c0ae04bb25c4216_115_Zn1Cd1Se2
[ "Cd", "Se", "Zn" ]
4
A2BC
CdSe2Zn
Zn1 Cd1 Se2
3
[ 1, 1, 1 ]
3
[ [ 3.94326029, 0, 0 ], [ 0, 3.94326029, 0 ], [ 0, 0, 5.5784425 ] ]
agm003153598
[ [ 0, 0, 2.78922125 ], [ 1.971630145, 1.971630145, 2.78922125 ], [ 0, 0, 0 ], [ 1.971630145, 1.971630145, 0 ] ]
[{"mass": null, "name": "Cd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cd"]}, {"mass": null, "name": "Se", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Se"]}, {"mass": null, "name": "Zn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zn"]}]
[ "Zn", "Se", "Se", "Cd" ]
2023-11-16 06:57:59
[ 0.25, 0.5, 0.25 ]
[ [ 3.036944, 0, 0 ], [ 0, 3.036944, 0 ], [ 0, 0, 3.7800462 ] ]
-10.781661
[ 0, 0, 0, 0 ]
[ [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ], [ 0, 0, 0 ] ]
0
1.005035
pbe
true
3e87db0d42632110075f05eba443e3e2_123_Zn1Cd1Se2
[ "Pa", "Sb", "Se" ]
4
A2BC
Pa2SbSe
Pa2 Sb1 Se1
3
[ 1, 1, 1 ]
3
[ [ 3.62466684, 0, 0 ], [ 0, 3.62466684, 0 ], [ 0, 0, 7.32770026 ] ]
agm001129407
[ [ 1.81233342, 1.81233342, 3.66385013 ], [ 0, 0, 5.549241906501096 ], [ 0, 0, 1.778458353498905 ], [ 1.81233342, 1.81233342, 0 ] ]
[{"mass": null, "name": "Pa", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pa"]}, {"mass": null, "name": "Sb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sb"]}, {"mass": null, "name": "Se", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Se"]}]
[ "Sb", "Pa", "Pa", "Se" ]
2023-11-16 06:57:59
[ 0.5, 0.25, 0.25 ]
[ [ 1.7188463, 0, 0 ], [ 0, 1.7188463, 0 ], [ 0, 0, 1.5272465 ] ]
-29.371119
[ -0.03, 0.82, 0.82, -0.027 ]
[ [ 0, 0, 0 ], [ 0, 0, -0.01140279 ], [ 0, 0, 0.01140279 ], [ 0, 0, 0 ] ]
1.92129
9.135753
pbe
true
9362558943329bb26706bbeb4b369edd_123_Pa2Sb1Se1
[ "Cd", "Se", "Zn" ]
4
A2BC
CdSe2Zn
Zn1 Cd1 Se2
3
[ 1, 1, 1 ]
3
[ [ 4.79750985, 0.018526, 0 ], [ -0.94930007, 4.70268789, 0 ], [ 0, 0, 3.70555627 ] ]
agm004154454
[ [ -0.474650035, 2.351343945, 1.852778135 ], [ 0, 0, 0 ], [ 1.92410489, 2.360606945, 0 ], [ 2.398754925, 0.009263, 1.852778135 ] ]
[{"mass": null, "name": "Cd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Cd"]}, {"mass": null, "name": "Se", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Se"]}, {"mass": null, "name": "Zn", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zn"]}]
[ "Cd", "Se", "Se", "Zn" ]
2023-11-16 06:57:59
[ 0.25, 0.5, 0.25 ]
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0.000002
1.091146
pbe
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92ca851103045f8df2dd96368736dd43_65_Zn1Cd1Se2
[ "Mn", "Ni", "O", "P" ]
36
A8B2CD
MnNiO8P2
Mn3 Ni3 O24 P6
4
[ 1, 1, 1 ]
3
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mp-771700
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2014-02-18 18:25:30
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[]
14.8
1.798359
pbe
true
e990041c2b5d3f95d674f5363e54510f_146_Mn3Ni3P6O24
[ "Mn", "Ni", "O", "Te" ]
24
A16B3C3D2
Mn3Ni2O16Te3
Mn3 Ni2 Te3 O16
4
[ 1, 1, 1 ]
3
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agm005225773
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2023-11-16 06:57:59
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14.977032
4.215046
pbe
true
451547fb77580d7b31d2017f8be743dd_8_Mn3Ni2Te3O16
[ "Cd", "Se", "Zr" ]
3
ABC
CdSeZr
Zr1 Cd1 Se1
3
[ 1, 1, 1 ]
3
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agm003809171
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[ "Cd", "Se", "Zr" ]
2023-11-16 06:57:59
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true
9375eb1d078fb9db9e8bfd6ac6c7b7b1_107_Zr1Cd1Se1