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[
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1
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[
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[
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[
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[
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1
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[
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1,
1
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] | 0.024248 | null | pbe | true | 977729ab0c7eb70cf8799d97e701db95_216_Ba1Er1Te1 |
[
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1,
1
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[
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0.32... | [{"mass": null, "name": "Ce", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ce"]}, {"mass": null, "name": "Ho", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ho"]}, {"mass": null, "name": "Ru", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ru"]}] | [
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... | 0.00013 | 13.207776 | pbe | true | 5c30fbd79262a1ccd3eeae4149f1f5ac_63_Ce2Ho6Ru4 |
[
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1,
1
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] | 0 | 4.08626 | pbe | true | 4fa31f5f53c69ca6b64eaa92a7774424_25_Sr1Ta1N1O2 |
[
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1,
1
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[
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[
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1,
1,
1
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[
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1,
1
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[
"Ce",
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1,
1,
1
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[
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0
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[
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[
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] | 1.631311 | 9.267852 | pbe | true | dac5d7b3dd9a135b393fe2c1d6f8c690_123_Ce2Tm1In1 |
[
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"Th",
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1,
1,
1
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[
3.94127445,
0,
0
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[
0,
3.94127445,
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[
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[
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[
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] | 0.000001 | 1.825686 | pbe | true | 8c25078439409f4dd6a913d8f68b27c5_123_Th1Zr1Sn2 |
[
"Ba",
"Lu",
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] | 3 | ABC | BaLuTa | Ba1 Lu1 Ta1 | 3 | [
1,
1,
1
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[
0,
3.743309,
3.743309
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[
3.743309,
0,
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[
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] | oqmd-3673529 | [
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[
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[
0,
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[
0,
0,
0
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] | 3.30291 | null | pbe | true | a90d903cc58f78cf977c494177acb8ef_216_Ba1Lu1Ta1 |
[
"Al",
"H",
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1,
1,
1
] | 3 | [
[
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0.00229888,
2.86852432
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[
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[
... | [{"mass": null, "name": "H", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["H"]}, {"mass": null, "name": "Al", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Al"]}, {"mass": null, "name": "Ti", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ti"]}] | [
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[
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-0.00421... | -0.000002 | 6.264746 | pbe | true | 1d786e15fd40972180d8de2f857a59c4_225_Ti6Al2H1 |
[
"N",
"Os",
"P",
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1,
1,
1
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[
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0,
0
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[
0,
2.82827,
0
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[
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[
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1.414135,
1.5436805580300... | [{"mass": null, "name": "S", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["S"]}, {"mass": null, "name": "Os", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Os"]}, {"mass": null, "name": "N", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["N"]}, {"mass": null, "name": "P", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["P"]}] | [
"P",
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[
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[
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[
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] | -0.000002 | 1.185236 | pbe | true | 118b96aa6bd380d42df8afd938271822_6_P2Os1S1N1 |
[
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1,
1,
1
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[
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[
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[
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] | 12 | A8B3C | CeIr8Tb3 | Tb3 Ce1 Ir8 | 3 | [
1,
1,
1
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0
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[
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[
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[
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1,
1
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[
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0.00... | 0.000001 | 5.404587 | pbe | true | 472d8a221467a3455f97c8cefa29332b_63_Pm2P2Ru4N2 |
[
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1,
1,
1
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[
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1,
1,
1
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] | -0.00006 | 0.324003 | pbe | true | 4d4e18767763c736196dd11aec32712d_107_Pm1U1P1N2 |
[
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1,
1,
1
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0
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[
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-0.00... | 0.000001 | 5.05934 | pbe | true | f122239d96f30de0fc4533e548fd89a0_63_Pr2P2Ru4N2 |
[
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1,
1,
1
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[... | [{"mass": null, "name": "Hf", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Hf"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "Al", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Al"]}] | [
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-0.001... | 0.000003 | 6.738013 | pbe | true | 3cb79c55c5d6b9db3e9591cf0ed95626_15_Hf8Al2O2 |
[
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1,
1
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[
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[
3.824... | [{"mass": null, "name": "S", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["S"]}, {"mass": null, "name": "Bi", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Bi"]}, {"mass": null, "name": "I", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["I"]}] | [
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[
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1,
1,
1
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0
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[
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[
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] | -0.01584 | null | pbe | true | 0f4049b00bb53eaa8fd72cd771447764_99_Tb1Pr1Te2As2 |
[
"N",
"P",
"Si",
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1,
1,
1
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2.00826698,
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[
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"N",
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[
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[
-0.000... | 1.890819 | 1.967436 | pbe | true | 19de20f581a84a1447c4c67f5ded5984_15_Tb2Si2P4N12 |
[
"N",
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] | 20 | A12B4C3D | N12P4SrU3 | Sr1 U3 P4 N12 | 4 | [
1,
1,
1
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[
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... | [{"mass": null, "name": "U", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["U"]}, {"mass": null, "name": "N", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["N"]}, {"mass": null, "name": "Sr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sr"]}, {"mass": null, "name": "P", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["P"]}] | [
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[
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0.... | 4.014603 | 11.576533 | pbe | true | 8fb211c7e8f5e56337108256b64e6504_155_Sr1U3P4N12 |
[
"N",
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"Pb",
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1,
1,
1
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[
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[
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[
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] | agm004709053 | [
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[
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"N",
"N",
"N",
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"N",
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] | 2023-11-16 06:57:59 | [
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[
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... | 2.417186 | 13.725035 | pbe | true | 817becf37774bcf8f4575c055db6289c_155_Pa3Tc4Pb1N12 |
[
"I",
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1,
1,
1
] | 3 | [
[
0,
3.8557682,
3.8557682
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[
3.8557682,
0,
3.8557682
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[
3.8557682,
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0
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] | agm002686264 | [
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[
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[
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] | [{"mass": null, "name": "Pb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pb"]}, {"mass": null, "name": "W", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["W"]}, {"mass": null, "name": "I", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["I"]}] | [
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[
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[
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] | -16.770846 | [
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[
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[
0,
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[
0,
0,
0
]
] | 3.368114 | 2.887451 | pbe | true | bcda2b0383e64617de6b764f8833b4bc_225_Pb2W1I1 |
[
"N",
"Pa",
"Pu",
"Sb"
] | 5 | A2BCD | N2PaPuSb | Pu1 Pa1 Sb1 N2 | 4 | [
1,
1,
1
] | 3 | [
[
3.91935943,
0,
0
],
[
0,
3.91935943,
0
],
[
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] | agm005000121 | [
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[
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2.465300127677524e-9,
3.1276035733982... | [{"mass": null, "name": "Sb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sb"]}, {"mass": null, "name": "Pa", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pa"]}, {"mass": null, "name": "Pu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pu"]}, {"mass": null, "name": "N", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["N"]}] | [
"Pu",
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] | 2023-11-16 06:57:59 | [
0.4,
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0.2,
0.2
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[
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0.19295985,
0
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[
0,
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] | -51.2362 | [
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[
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[
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[
0,
0,
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[
0,
0,
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] | 4.527829 | 9.803949 | pbe | true | 54e093b841ab0349447301df72e58693_107_Pu1Pa1Sb1N2 |
[
"N",
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"S",
"Tb"
] | 5 | A2BCD | N2PaSTb | Tb1 Pa1 S1 N2 | 4 | [
1,
1,
1
] | 3 | [
[
3.85403315,
0,
0
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[
0,
3.85403315,
0
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[
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] | agm005010482 | [
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[
1.9270165918285171,
1.682851747235381e-8,
2.9338126863006... | [{"mass": null, "name": "S", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["S"]}, {"mass": null, "name": "Tb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tb"]}, {"mass": null, "name": "Pa", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pa"]}, {"mass": null, "name": "N", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["N"]}] | [
"Tb",
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] | 2023-11-16 06:57:59 | [
0.4,
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0.2,
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[
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[
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] | -43.74916 | [
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[
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[
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[
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] | -0.000004 | 0 | pbe | true | f25421e80188d0e90fa2bdf6ec04f8d6_107_Tb1Pa1S1N2 |
[
"Be",
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"Si"
] | 8 | A2BC | BeOs2Si | Be2 Si2 Os4 | 3 | [
1,
1,
1
] | 3 | [
[
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0,
0
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[
0,
6.20142759,
0
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[
3.1007138,
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] | agm002803453 | [
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[
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[
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4.651070... | [{"mass": null, "name": "Be", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Be"]}, {"mass": null, "name": "Si", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Si"]}, {"mass": null, "name": "Os", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Os"]}] | [
"Be",
"Be",
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"Si",
"Os",
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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,
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[
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10.005901
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] | -58.748857 | [
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0.002,
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0.002
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[
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[
0,
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[
0,
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0
]
] | 0.007255 | 11.211106 | pbe | true | 3f3d8372189f3c0fb1cf4f70eeac98e9_122_Be2Si2Os4 |
[
"N",
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"Se",
"Tb"
] | 5 | A2BCD | N2PaSeTb | Tb1 Pa1 Se1 N2 | 4 | [
1,
1,
1
] | 3 | [
[
3.90437776,
0,
0
],
[
0,
3.90437776,
0
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[
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] | agm005010443 | [
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[
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[
... | [{"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"]}, {"mass": null, "name": "Pa", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pa"]}, {"mass": null, "name": "N", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["N"]}] | [
"Tb",
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"Se",
"N",
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] | 2023-11-16 06:57:59 | [
0.4,
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0.2,
0.2
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0
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[
0,
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[
0,
0,
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] | -43.223824 | [
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[
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[
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[
0,
0,
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[
0,
0,
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] | 0 | 0 | pbe | true | 29bdd475dbc972a26dd9123403bc1860_107_Tb1Pa1Se1N2 |
[
"Be",
"Os",
"Sr"
] | 4 | A2BC | BeOs2Sr | Sr1 Be1 Os2 | 3 | [
1,
1,
1
] | 3 | [
[
2.98531832,
0,
0
],
[
0,
2.98531832,
0
],
[
0,
0,
7.55841029
]
] | agm004256095 | [
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[
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1.4100083635496983
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[
1.49265916,
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] | [{"mass": null, "name": "Os", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Os"]}, {"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",
"Os",
"Os",
"Be"
] | 2023-11-16 06:57:59 | [
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[
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1,
1
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[
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1
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[
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1
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[
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1,
1
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[
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1,
1
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[
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1,
1,
1
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[
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1,
1,
1
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0.02887... | -0.339746 | 28.108212 | pbe | true | e312336973d08d26c3e1522b4fab7189_63_Ce4Mg2Tl6 |
[
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1,
1
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... | 0 | 5.501308 | pbe | true | 8c3e803984c5ffac0ed2518d7b4d60cd_127_Mg4In4Bi2 |
[
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1,
1
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2.00497040995029... | [{"mass": null, "name": "Ba", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ba"]}, {"mass": null, "name": "Ta", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ta"]}, {"mass": null, "name": "Tl", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tl"]}, {"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}] | [
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[
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[
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1
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[... | -0.010838 | null | pbe | true | cd650d582717866daa17ff9527e1bbbb_15_Zr8Sc4Sn6N6 |
[
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1
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[
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1,
1
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[
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1,
1,
1
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] | 0.000001 | 4.443347 | pbe | true | a71a430c4f05f8256678f604bf105344_10_Tb1Pr1Th2Sb4 |
[
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1,
1,
1
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3.6291732604... | [{"mass": null, "name": "Be", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Be"]}, {"mass": null, "name": "P", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["P"]}, {"mass": null, "name": "Ta", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ta"]}, {"mass": null, "name": "Y", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Y"]}] | [
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... | 0.128031 | null | pbe | true | b9fd6085903ff76095e72935fc09ec5a_87_Y2Ta1Be1P6 |
[
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1,
1,
1
] | 3 | [
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3.39881959,
0,
0
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1.6994098,
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1.6994098,
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-0.00120581,... | 0 | 1.838918 | pbe | true | fc26be3c483e491c2a2a3fb4b32c8ef5_29_Na24Nd8P16O64 |
[
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1,
1,
1
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1.915,
1.914... | [] | 27.614 | 4.462288 | pbe | true | f0b6c14642a6c6a07a87d7636d37a1ea_167_Na6Nd28Ru12O72 |
[
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1,
1,
1
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0
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[
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4.0... | [{"mass": null, "name": "Bi", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Bi"]}, {"mass": null, "name": "Na", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Na"]}, {"mass": null, "name": "Se", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Se"]}, {"mass": null, "name": "Si", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Si"]}] | [
"Na",
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] | 2023-11-16 06:57:59 | [
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[
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[
"Be",
"O",
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] | 5 | A3BC | Be3OTl | Be3 Tl1 O1 | 3 | [
1,
1,
1
] | 3 | [
[
4.51853196,
0,
0
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[
0,
4.51853196,
0
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[
0,
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] | [{"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "Tl", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tl"]}, {"mass": null, "name": "Be", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Be"]}] | [
"Be",
"Be",
"Be",
"Tl",
"O"
] | 2023-11-16 06:57:59 | [
0.6,
0.2,
0.2
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[
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[
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[
0,
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[
0,
0,
0
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[
0,
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0
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] | 1 | 3.442163 | pbe | true | 2caca39b18e4053cf6682b15fd5e1677_221_Be3Tl1O1 |
[
"Be",
"O",
"Zr"
] | 4 | A2BC | BeOZr2 | Zr2 Be1 O1 | 3 | [
1,
1,
1
] | 3 | [
[
0,
3.07736942,
3.07736942
],
[
3.07736942,
0,
3.07736942
],
[
3.07736942,
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0
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] | agm002647070 | [
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[
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[
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[
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] | [{"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "Zr", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Zr"]}, {"mass": null, "name": "Be", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Be"]}] | [
"Be",
"O",
"Zr",
"Zr"
] | 2023-11-16 06:57:59 | [
0.25,
0.25,
0.5
] | [
[
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0
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[
0,
2.6251884,
0
],
[
0,
0,
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]
] | -27.243572 | [
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[
0,
0,
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[
0,
0,
0
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[
0,
0,
0
]
] | 0 | 1.70899 | pbe | true | 6a226fb90c34431c80d493908c47b7c0_225_Zr2Be1O1 |
[
"Na",
"Nd",
"Sb",
"Te"
] | 12 | A3BCD | NaNdSbTe3 | Na1 Nd1 Sb1 Te3 | 4 | [
1,
1,
1
] | 3 | [
[
2.235975462,
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0
],
[
2.235975462,
7.917615255,
0
],
[
0,
0,
10.970582415
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] | oqmd-7485482 | [
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[
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[
2.23598,
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[
2.2359800000000005,
7.51... | [{"mass": null, "name": "Na", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Na"]}, {"mass": null, "name": "Nd", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Nd"]}, {"mass": null, "name": "Sb", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sb"]}, {"mass": null, "name": "Te", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Te"]}] | [
"Na",
"Na",
"Nd",
"Nd",
"Sb",
"Sb",
"Te",
"Te",
"Te",
"Te",
"Te",
"Te"
] | 2024-11-01 00:00:00 | [
0.16666666666666666,
0.16666666666666666,
0.16666666666666666,
0.5
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0,
0
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[
0,
2.33341928,
0
],
[
0,
0,
2.83811866
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] | -47.3425 | [
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0,
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0,
0,
0,
0,
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[
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0
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[
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[
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[
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[
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0.021679
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[
0,
0.0009,
0
],
[
0,
-0.042111,
-0.021... | 0.0086 | null | pbe | true | bcb10280f0b7f8e78a6c997a7844443a_63_Na2Nd2Sb2Te6 |
[
"Ce",
"Pu",
"Tl"
] | 11 | A5B3C3 | Ce3Pu3Tl5 | Ce3 Pu3 Tl5 | 3 | [
1,
1,
1
] | 3 | [
[
3.41168315,
0,
0
],
[
0,
9.02518653,
-5.21069263
],
[
0,
0.00000119,
10.4213876
]
] | agm005684859 | [
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0,
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[
0,
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6.540089146800664
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[
0,
3.3613035501596387,
1.940649662349624
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[
1.705841575,
7.516976344214288,
6.081461006155129
],
[
1.705841575,
1.5082115746482534,
0.87076642... | [{"mass": null, "name": "Tl", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Tl"]}, {"mass": null, "name": "Ce", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ce"]}, {"mass": null, "name": "Pu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pu"]}] | [
"Ce",
"Ce",
"Ce",
"Pu",
"Pu",
"Pu",
"Tl",
"Tl",
"Tl",
"Tl",
"Tl"
] | 2023-11-16 06:57:59 | [
0.2727272727272727,
0.2727272727272727,
0.45454545454545453
] | [
[
2.422213,
0,
0
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[
0,
2.4789238,
6e-7
],
[
0,
6e-7,
2.4789233
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] | -71.129353 | [
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-0.822,
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0.01,
0.01,
0.01,
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0.01
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[
0,
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[
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[
0,
0,
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[
0,
0,
0
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[
0,
0,
... | -19.883629 | 14.956574 | pbe | true | 9f9f4c171445bac2b922edf91fcd7382_189_Ce3Pu3Tl5 |
[
"Be",
"Os",
"Pt"
] | 5 | A3BC | BeOs3Pt | Be1 Os3 Pt1 | 3 | [
1,
1,
1
] | 3 | [
[
4.73622729,
0,
0
],
[
0,
4.73622729,
0
],
[
0,
0,
4.73622729
]
] | agm002421473 | [
[
2.368113645,
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2.368113645
],
[
0,
2.368113645,
0
],
[
0,
0,
2.368113645
],
[
2.368113645,
0,
0
],
[
0,
0,
0
]
] | [{"mass": null, "name": "Be", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Be"]}, {"mass": null, "name": "Pt", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pt"]}, {"mass": null, "name": "Os", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Os"]}] | [
"Be",
"Os",
"Os",
"Os",
"Pt"
] | 2023-11-16 06:57:59 | [
0.2,
0.6,
0.2
] | [
[
1.2771144,
0,
0
],
[
0,
1.2771144,
0
],
[
0,
0,
1.2771144
]
] | -28.921174 | [
0,
0.001,
0,
0,
0
] | [
[
0,
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0
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[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
],
[
0,
0,
0
]
] | 0.000967 | 8.869751 | pbe | true | 3ad66b19c1dc3b328928d48f3d782dcf_221_Be1Os3Pt1 |
[
"Ce",
"Na",
"S"
] | 4 | A2BC | CeNaS2 | Ce1 Na1 S2 | 3 | [
1,
1,
1
] | 3 | [
[
-2.92860278,
-2.92860278,
0
],
[
0,
2.92860278,
-2.92860278
],
[
2.88167704,
-2.88167704,
-5.81027982
]
] | mp-1221073 | [
[
-0.023462869999999914,
-2.90513991,
-2.90513991
],
[
0,
0,
0
],
[
-0.078644283656511,
0.078644283656511,
-2.849958496343489
],
[
0.031718543656511056,
-2.960321323656511,
-5.88892410365651
]
] | [{"mass": null, "name": "Ce", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ce"]}, {"mass": null, "name": "Na", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Na"]}, {"mass": null, "name": "S", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["S"]}] | [
"Na",
"Ce",
"S",
"S"
] | 2019-01-12 21:49:18 | [
0.25,
0.25,
0.5
] | [
[
-3.04138842,
0.28728726,
0.28728726
],
[
0.28728726,
-3.04138842,
-0.28728726
],
[
0.28728726,
-0.28728726,
-3.04138842
]
] | -22.454842 | [
0,
0.925,
-0.019,
-0.019
] | [
[
0,
0,
0
],
[
0,
0,
0
],
[
-0.01965472,
0.01965472,
0.01965472
],
[
0.01965472,
-0.01965472,
-0.01965472
]
] | 0.887 | 5.163279 | pbe | true | 23362f64e139444139c1320d605b851f_166_Na1Ce1S2 |
[
"Na",
"Ni",
"O",
"Pu"
] | 20 | A6B2CD | Na2NiO6Pu | Na4 Pu2 Ni2 O12 | 4 | [
1,
1,
1
] | 3 | [
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[
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[
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1,
1
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... | 2.074822 | 6.14288 | pbe | true | 0bcc6337540dd7b78f7aa204b0a5f895_164_Rb2Pm1As1O6 |
[
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[
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0
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[
0,
0,
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[
0,
0,
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]
] | 0.322976 | 7.569716 | pbe | true | e4e92b325e1128b2f655e14d4344325c_166_Ce1Pm2Pa1 |
[
"Na",
"Np",
"O",
"Si"
] | 20 | A6B2CD | NaNpO6Si2 | Na2 Np2 Si4 O12 | 4 | [
1,
1,
1
] | 3 | [
[
7.18623782,
0.55944141,
0.57720461
],
[
-0.32456684,
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0.57720461
],
[
-1.27435377,
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]
] | agm004944372 | [
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[
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[
1.1113557... | [{"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "Na", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Na"]}, {"mass": null, "name": "Np", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Np"]}, {"mass": null, "name": "Si", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Si"]}] | [
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"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O"
] | 2023-11-16 06:57:59 | [
0.1,
0.1,
0.6,
0.2
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[
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[
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[
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3.924,
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0.002,
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0.002,
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0.001,
0.001,
0.001,
0.001,
-0.026,
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[
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[
-0.00... | 8.00004 | 18.098795 | pbe | true | 4504ba447e16ba8a84fdab3abce8d862_15_Na2Np2Si4O12 |
[
"Ce",
"Pa",
"Re"
] | 4 | A2BC | CePa2Re | Ce1 Pa2 Re1 | 3 | [
1,
1,
1
] | 3 | [
[
4.98116567,
0,
0
],
[
2.49058284,
4.31381601,
0
],
[
2.49058284,
1.43793867,
4.06710474
]
] | agm001089202 | [
[
0,
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0
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[
2.4905828375,
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1.016776185
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[
7.4717485125,
4.31381601,
3.050328555
],
[
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2.87587734,
2.03355237
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] | [{"mass": null, "name": "Pa", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pa"]}, {"mass": null, "name": "Re", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Re"]}, {"mass": null, "name": "Ce", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ce"]}] | [
"Re",
"Pa",
"Pa",
"Ce"
] | 2023-11-16 06:57:59 | [
0.25,
0.5,
0.25
] | [
[
1.9083544,
0,
0
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[
0,
1.9083544,
0
],
[
0,
0,
1.9083544
]
] | -36.711172 | [
0,
-0.003,
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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
]
] | -0.009273 | 12.322832 | pbe | true | 9b07d9c35268acb57e8ea0ab0fa04fbf_225_Ce1Pa2Re1 |
[
"Co",
"Pu",
"Te"
] | 3 | ABC | CoPuTe | Pu1 Co1 Te1 | 3 | [
1,
1,
1
] | 3 | [
[
4.50001056,
0,
0
],
[
2.25000528,
3.89545157,
0.00063894
],
[
2.25000528,
1.29909358,
3.67304459
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] | agm002144820 | [
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4.500010537499946,
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[
2.25000528,
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[
4.500010537499947,
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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"]}, {"mass": null, "name": "Pu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pu"]}] | [
"Te",
"Co",
"Pu"
] | 2023-11-16 06:57:59 | [
0.3333333333333333,
0.3333333333333333,
0.3333333333333333
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[
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[
0,
3.206523,
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],
[
0,
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3.2304313
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] | -25.943107 | [
0.041,
0.607,
-5.29
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[
0,
0.00208742,
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[
0,
-0.00095686,
-0.0002565
],
[
0,
-0.00113056,
-0.00046284
]
] | -4.999931 | 9.270451 | pbe | true | 8b6f50b65bfce68e185861f9a0943265_216_Pu1Co1Te1 |
[
"Ge",
"Pt",
"Sm"
] | 16 | A2BC | Ge2PtSm | Ge8 Pt4 Sm4 | 3 | [
1,
1,
1
] | 3 | [
[
4.41211421,
0,
0
],
[
0,
8.81404924,
0
],
[
-2.20605711,
-4.40702462,
8.25059318
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] | mp-1005755 | [
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0,
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0
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0,
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0
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[
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4.4070290270246195,
4.902946514480948
],
[
2.2060593103145,
-0.000004407024619827102,
... | [{"mass": null, "name": "Ge", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Ge"]}, {"mass": null, "name": "Pt", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pt"]}, {"mass": null, "name": "Sm", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sm"]}] | [
"Sm",
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"Sm",
"Sm",
"Ge",
"Ge",
"Ge",
"Ge",
"Ge",
"Ge",
"Ge",
"Ge",
"Pt",
"Pt",
"Pt",
"Pt"
] | 2016-08-31 21:35:58 | [
0.5,
0.25,
0.25
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0,
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0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0,
0
] | [] | 0 | 5.075232 | pbe | true | 89afc2f3b968344e6960937aa594e93a_71_Sm4Ge8Pt4 |
[
"Na",
"O",
"Os",
"Sc"
] | 10 | A6B2CD | Na2O6OsSc | Na2 O6 Os1 Sc1 | 4 | [
1,
1,
1
] | 3 | [
[
-2.72608037,
2.72608037,
3.950634741
],
[
2.72608037,
-2.72608037,
3.950634741
],
[
2.72608037,
2.72608037,
-3.950634741
]
] | oqmd-6802689 | [
[
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1.9753200000000009
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[
2.72608,
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[
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1.88723
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[
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1.8486785190010461e-16,
6.01404
],
[
1.7338100... | [{"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": "Os", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Os"]}, {"mass": null, "name": "Sc", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Sc"]}] | [
"Na",
"Na",
"O",
"O",
"O",
"O",
"O",
"O",
"Os",
"Sc"
] | 2024-11-01 00:00:00 | [
0.2,
0.6,
0.1,
0.1
] | [
[
42.77971362,
-4e-7,
0
],
[
-4e-7,
42.77971362,
0
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[
0,
0,
43.12996805
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] | -68.7224 | [
0,
0,
0,
0,
0,
0,
0,
0,
0,
0
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[
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[
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[
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0
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[
-0.056585,
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0
],
[
0,
... | 0.000276 | null | pbe | true | edc90d5094d1b4052e6f7f74646fbe84_87_Na2Sc1Os1O6 |
[
"Na",
"O",
"P",
"Pu"
] | 20 | A6B2CD | NaO6P2Pu | Na2 Pu2 P4 O12 | 4 | [
1,
1,
1
] | 3 | [
[
6.85991335,
0.7564097,
-0.06422447
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[
-0.08912888,
6.90091464,
-0.06422447
],
[
-2.03180085,
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5.94398696
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] | agm004945441 | [
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[
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[
1.2931307902126896,
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[
1.5939665269616683,
... | [{"mass": null, "name": "O", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["O"]}, {"mass": null, "name": "Na", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Na"]}, {"mass": null, "name": "Pu", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["Pu"]}, {"mass": null, "name": "P", "attached": null, "nattached": null, "concentration": [1], "original_name": null, "chemical_symbols": ["P"]}] | [
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"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O",
"O"
] | 2023-11-16 06:57:59 | [
0.1,
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0.2,
0.1
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[
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[
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[
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] | -157.796462 | [
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[
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[
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[
0.0... | 9.999999 | 18.939224 | pbe | true | 1f689bb9f716e6cd52ff96b1bb209b99_15_Na2Pu2P4O12 |