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[
0.5,
0,
0.5
],
[
0.713492,
0.235919,
0.713492
],
[
0.713492,
0.713492,
0.23... | [
40,
22,
22,
28,
28,
28,
28,
28,
28,
28,
28,
28
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[
4.797162529672478,
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[
2.0209462978239072,
4.350694702849821,
5.093263580154461
],
[
0,
0,
6.99672165
]
] | {
"object": {
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"band_gap": 0,
"pretty_formula": "ZrTi2Ni9",
"e_above_hull": 0.0210753208333338,
"elements": "['Ni', 'Ti', 'Zr']",
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}
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[
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[
0.75,
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0.75
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[
0.5,
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[
0,
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0
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[
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[
0.2304,
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[
0.7696,
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0.2304
],
[
0.7696,
0.2304,
0.2304
],
... | [
56,
56,
70,
75,
8,
8,
8,
8,
8,
8
] | [
[
5.161120205559857,
0,
2.9797741400000004
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[
1.7203734018532857,
4.865950794493711,
2.9797741400000004
],
[
0,
0,
5.95954828
]
] | {
"object": {
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"band_gap": 0,
"pretty_formula": "Ba2YbReO6",
"e_above_hull": 0,
"elements": "['Ba', 'O', 'Re', 'Yb']",
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}
} |
[
[
0.5,
0,
0.5
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[
0,
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0.5
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[
0,
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[
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[
0.752158,
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0
],
[
0.24912,
0.24912,
0.5
],
[
0.75088,
0.75088,
0.5
]
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25,
25,
50,
16,
16,
16,
16
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[
6.37413723,
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3.903033378022738e-16
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[
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6.006549964303835,
3.903033378022738e-16
],
[
0,
0,
3.679597
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] | {
"object": {
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"pretty_formula": "Mn2SnS4",
"e_above_hull": 0.0728561950000079,
"elements": "['Mn', 'Sn', 'S']",
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}
} |
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