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{
"id": "mp-685341",
"created_at": "2022-09-04T14:47:31.032234Z",
"structure_string": "Bi32 Ru32 O110\n1.0\n6.345503 0.000025 3.663670\n2.115191 5.982589 3.663670\n0.024476 0.017307 58.576315\nBi Ru O\n32 32 110\ndirect\n0.503150 0.986268 0.063434 Bi\n0.503119 0.503119 0.063442 Bi\n-0.000032 0.499953 0.187506 Bi\n0.506880 0.506880 0.122420 Bi\n0.499953 -0.000032 0.187506 Bi\n0.986268 0.503150 0.063434 Bi\n0.500037 0.500037 0.187493 Bi\n0.013541 0.496896 0.311585 Bi\n0.493188 0.493188 0.252555 Bi\n0.496896 0.013541 0.311585 Bi\n0.496886 0.496886 0.311588 Bi\n0.000830 0.500007 0.437397 Bi\n0.503078 0.503078 0.373846 Bi\n0.500007 0.000830 0.437397 Bi\n0.499990 0.499990 0.437399 Bi\n0.500184 0.500184 0.499931 Bi\n0.499900 0.499900 0.562516 Bi\n0.499979 -0.000042 0.687507 Bi\n0.499897 0.000074 0.562516 Bi\n0.499944 0.499944 0.625021 Bi\n0.000074 0.499897 0.562516 Bi\n0.500006 0.500006 0.687504 Bi\n-0.000058 0.500151 0.812472 Bi\n0.500151 -0.000058 0.812472 Bi\n0.500003 0.500003 0.749999 Bi\n-0.000042 0.499979 0.687507 Bi\n0.500131 0.500131 0.812475 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O\n0.374707 0.374707 0.921985 O\n0.625109 0.625109 0.828085 O\n0.920459 0.329346 0.791215 O\n0.328747 0.921048 0.865184 O\n0.079160 0.671227 0.958806 O\n0.329166 0.329166 0.990080 O\n0.329545 0.920745 0.916122 O\n0.920395 0.920395 0.791243 O\n0.921048 0.328747 0.865184 O\n0.671227 0.079160 0.958806 O\n0.671001 0.671001 0.884869 O\n0.920745 0.329545 0.916122 O\n0.621470 0.621470 0.954448 O\n0.328927 0.921108 0.990090 O\n0.921108 0.328927 0.990090 O\n0.920724 0.920724 0.916125 O\n",
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"elements": [
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"chemical_system": "Bi-O-Ru",
"density": 8.726296698710428,
"density_atomic": 0.07827620693972938,
"volume": 2222.897695259754,
"volume_molar": 7.693449894214842,
"formula_full": "Bi32 Ru32 O110",
"formula_reduced": "Bi16Ru16O55",
"formula_anonymous": "A16B16C55",
"energy": -1231.84426433,
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"total_magnetization": 0.145826,
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"updated_at": "2021-11-28T01:38:13.701000Z",
"spacegroup": 166
},
{
"id": "mp-662803",
"created_at": "2022-09-04T14:40:26.507370Z",
"structure_string": "K12 Ba6 Ge48 O108\n1.0\n5.953982 -10.312600 0.000000\n5.953982 10.312600 0.000000\n0.000000 0.000000 19.586866\nK Ba Ge O\n12 6 48 108\ndirect\n0.662679 0.998298 0.539349 K\n0.001702 0.664382 0.539349 K\n0.998298 0.335618 0.460651 K\n0.664382 0.662679 0.460651 K\n0.335618 0.998298 0.039349 K\n0.001702 0.337321 0.039349 K\n0.337321 0.335618 0.960651 K\n0.662679 0.664382 0.039349 K\n0.664382 0.001702 0.960651 K\n0.335618 0.337321 0.539349 K\n0.337321 0.001702 0.460651 K\n0.998298 0.662679 0.960651 K\n0.335134 0.000000 0.250000 Ba\n0.664866 0.000000 0.750000 Ba\n0.664866 0.664866 0.250000 Ba\n0.335134 0.335134 0.750000 Ba\n0.000000 0.335134 0.250000 Ba\n0.000000 0.664866 0.750000 Ba\n0.144817 0.661552 0.149241 Ge\n0.338448 0.855183 0.649241 Ge\n0.661552 0.516735 0.850759 Ge\n0.154849 0.666419 0.391264 Ge\n0.177807 0.003605 0.872675 Ge\n0.003605 0.825798 0.127325 Ge\n0.174202 0.177807 0.127325 Ge\n0.003605 0.177807 0.627325 Ge\n0.177807 0.174202 0.372675 Ge\n0.333333 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"elements": [
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],
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"density": 4.492751971183854,
"density_atomic": 0.07234001761776072,
"volume": 2405.3076807280177,
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"formula_full": "K12 Ba6 Ge48 O108",
"formula_reduced": "K2Ba(Ge4O9)2",
"formula_anonymous": "AB2C8D18",
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"updated_at": "2021-11-28T01:34:57.876000Z",
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},
{
"id": "mp-1194814",
"created_at": "2022-09-04T14:44:20.501153Z",
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"updated_at": "2021-11-28T01:38:20.283000Z",
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},
{
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},
{
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