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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=147",
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{
"id": "jvasp-9565",
"created_at": "2022-09-04T14:37:14.703263Z",
"updated_at": "2022-09-04T14:37:14.703292Z",
"structure_string": "Zn4 Sb4 O10\n1.0\n3.326077 0.003792 0.313476\n-0.005070 9.429310 -0.060379\n0.884001 0.054268 8.408409\nZn Sb O\n4 4 10\ndirect\n0.536326 0.035547 0.177695 Zn\n0.211895 -0.030055 0.827297 Zn\n0.463680 0.535545 0.322302 Zn\n0.788117 0.469950 0.672703 Zn\n-0.112419 0.840515 0.475604 Sb\n0.367284 0.208541 0.514154 Sb\n-0.367286 0.708540 0.985851 Sb\n0.112420 0.340514 0.024391 Sb\n0.448992 0.749340 0.352094 O\n0.025642 0.491657 0.198315 O\n0.550985 0.249338 0.147904 O\n0.206038 0.741548 0.839061 O\n0.351203 0.462255 0.546558 O\n0.326795 0.000657 0.595875 O\n-0.326790 0.500654 0.904127 O\n-0.351199 0.962250 -0.046559 O\n-0.025639 0.991662 0.301684 O\n0.793967 0.241548 0.660944 O\n",
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"spacegroup": 36
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{
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"structure_string": "Zn4 Sb4 O10\n1.0\n3.233428 0.000000 0.000000\n0.000000 8.764379 0.000000\n-0.000000 0.000000 8.492494\nZn Sb O\n4 4 10\ndirect\n0.500000 0.507428 0.312849 Zn\n0.500000 0.492572 0.687151 Zn\n0.500000 0.007428 0.187151 Zn\n0.500000 0.992573 0.812848 Zn\n-0.000000 0.713169 0.030469 Sb\n-0.000000 0.286831 0.969530 Sb\n-0.000000 0.786831 0.530469 Sb\n-0.000000 0.213169 0.469530 Sb\n0.500000 0.774344 0.172503 O\n-0.000000 0.026072 0.331266 O\n0.500000 0.274344 0.327497 O\n0.500000 0.725656 0.672503 O\n0.000000 0.000000 0.000000 O\n-0.000000 0.473928 0.831266 O\n-0.000000 0.973928 0.668733 O\n-0.000000 0.500000 0.500000 O\n-0.000000 0.526072 0.168734 O\n0.500000 0.225656 0.827497 O\n",
"nsites": 18,
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],
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"density": 6.269540242031567,
"density_atomic": 0.07479161514288273,
"volume": 240.66868947291218,
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"formula_full": "Zn4 Sb4 O10",
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{
"id": "jvasp-41137",
"created_at": "2022-09-04T14:37:35.384968Z",
"updated_at": "2022-09-04T14:37:35.384983Z",
"structure_string": "Zn2 Rh1 Au1\n1.0\n0.000001 3.093194 3.093201\n3.093195 0.000003 3.093199\n3.093198 3.093195 0.000000\nZn Rh Au\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500002 0.500000 Zn\n0.749999 0.750000 0.749997 Rh\n0.250000 0.250000 0.249999 Au\n",
"nsites": 4,
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"density_atomic": 0.06757834249847304,
"volume": 59.19056094177482,
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"formula_full": "Zn2 Rh1 Au1",
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"spacegroup": 225
},
{
"id": "jvasp-75583",
"created_at": "2022-09-04T14:35:45.679803Z",
"updated_at": "2022-09-04T14:35:45.679835Z",
"structure_string": "Zn2 Re1 As1\n1.0\n-0.000000 3.138503 3.138503\n3.138503 0.000000 3.138503\n3.138503 3.138503 0.000000\nZn Re As\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Zn\n0.749999 0.749999 0.749999 Zn\n0.250000 0.250000 0.250000 Re\n0.500000 0.500000 0.500000 As\n",
"nsites": 4,
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"elements": [
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"density": 10.526363397062157,
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"volume": 61.82977128669998,
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"formula_full": "Zn2 Re1 As1",
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"spacegroup": 216
},
{
"id": "jvasp-38821",
"created_at": "2022-09-04T14:38:03.512092Z",
"updated_at": "2022-09-04T14:38:03.512112Z",
"structure_string": "Zn2 Pt1 Rh1\n1.0\n0.000000 3.046941 3.046941\n3.046941 -0.000000 3.046941\n3.046941 3.046941 0.000000\nZn Pt Rh\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Zn\n0.250000 0.250000 0.250000 Pt\n0.750000 0.750000 0.750000 Rh\n",
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"density_atomic": 0.07070300319586799,
"volume": 56.57468309965322,
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{
"id": "jvasp-13305",
"created_at": "2022-09-04T14:36:50.548954Z",
"updated_at": "2022-09-04T14:36:50.548965Z",
"structure_string": "Zn4 Pt2 O8\n1.0\n6.138705 0.032240 0.109225\n3.097273 5.364634 0.000000\n3.167840 1.747469 4.960625\nZn Pt O\n4 2 8\ndirect\n0.976224 0.023777 0.976224 Zn\n0.273776 0.226224 0.273776 Zn\n0.125000 0.624999 0.625000 Zn\n0.625001 0.625000 0.124999 Zn\n0.625000 0.125000 0.625000 Pt\n0.625000 0.625000 0.625000 Pt\n0.392640 0.375492 0.392640 O\n0.392640 0.839229 0.392640 O\n0.398955 0.374192 0.852659 O\n0.852660 0.374192 0.398954 O\n0.397341 0.875807 0.851046 O\n0.857361 0.410771 0.857360 O\n0.851046 0.875807 0.397341 O\n0.857360 0.874508 0.857360 O\n",
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"elements": [
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],
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"density": 8.012793297990635,
"density_atomic": 0.0866323494473241,
"volume": 161.6024509240922,
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"formula_full": "Zn4 Pt2 O8",
"formula_reduced": "Zn2PtO4",
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"spacegroup": 74
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{
"id": "jvasp-14120",
"created_at": "2022-09-04T14:38:05.651130Z",
"updated_at": "2022-09-04T14:38:05.651154Z",
"structure_string": "Zn4 P6 S18\n1.0\n6.520436 0.019082 0.550504\n0.471318 9.225232 5.163410\n0.040773 0.011981 10.582346\nZn P S\n4 6 18\ndirect\n0.323000 0.951646 0.300550 Zn\n0.677001 0.048354 0.699450 Zn\n0.322999 0.300550 0.951646 Zn\n0.677001 0.699450 0.048354 Zn\n0.289967 0.623857 0.623857 P\n0.375461 0.281382 0.281382 P\n0.624540 0.718618 0.718618 P\n0.651842 0.024247 0.024247 P\n0.348158 0.975752 0.975753 P\n0.710034 0.376143 0.376143 P\n0.705814 0.258685 0.258685 S\n0.294186 0.741315 0.741315 S\n0.327293 0.757462 0.081190 S\n0.844473 0.566745 0.267078 S\n0.155528 0.732921 0.433255 S\n0.155527 0.433255 0.732922 S\n0.844473 0.267078 0.566745 S\n0.755785 0.907786 0.584232 S\n0.755785 0.584232 0.907786 S\n0.244215 0.092214 0.415768 S\n0.327293 0.081190 0.757463 S\n0.846934 0.926616 0.926617 S\n0.672707 0.918809 0.242538 S\n0.380572 0.397825 0.397825 S\n0.619429 0.602175 0.602175 S\n0.153066 0.073384 0.073384 S\n0.244215 0.415768 0.092214 S\n0.672707 0.242537 0.918810 S\n",
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"S"
],
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"density": 2.6758696664350365,
"density_atomic": 0.044035096374792575,
"volume": 635.8564487218496,
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"formula_full": "Zn4 P6 S18",
"formula_reduced": "Zn2(PS3)3",
"formula_anonymous": "A2B3C9",
"energy_above_hull": 1.98702195,
"spacegroup": 12
},
{
"id": "jvasp-52409",
"created_at": "2022-09-04T14:37:03.240383Z",
"updated_at": "2022-09-04T14:37:03.240399Z",
"structure_string": "Zn4 P2 H2 O10\n1.0\n5.553683 0.029463 0.041485\n0.294231 5.733682 0.009684\n1.445450 1.324817 6.241800\nZn P H O\n4 2 2 10\ndirect\n0.385315 0.248683 0.508577 Zn\n0.614685 0.751317 0.491421 Zn\n0.026099 0.737373 0.811892 Zn\n0.973901 0.262627 0.188107 Zn\n0.832397 0.249955 0.726518 P\n0.167603 0.750045 0.273480 P\n0.434678 0.905993 0.825347 H\n0.565322 0.094007 0.174652 H\n0.027849 0.248097 0.513298 O\n0.972151 0.751903 0.486701 O\n0.405543 0.619715 0.329196 O\n0.594457 0.380285 0.670802 O\n0.771083 0.992762 0.851996 O\n0.939655 0.387698 0.865980 O\n0.228917 0.007238 0.148003 O\n0.360311 0.889121 0.705893 O\n0.060345 0.612302 0.134019 O\n0.639689 0.110879 0.294105 O\n",
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"formula_full": "Zn4 P2 H2 O10",
"formula_reduced": "Zn2PHO5",
"formula_anonymous": "ABC2D5",
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"spacegroup": 2
},
{
"id": "jvasp-41134",
"created_at": "2022-09-04T14:37:34.748590Z",
"updated_at": "2022-09-04T14:37:34.748621Z",
"structure_string": "Zn2 Pd1 Rh1\n1.0\n0.000000 3.039728 3.039728\n3.039728 0.000000 3.039728\n3.039728 3.039728 -0.000000\nZn Pd Rh\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500001 0.500001 0.500001 Zn\n0.250000 0.250000 0.250000 Pd\n0.750000 0.750000 0.750000 Rh\n",
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"formula_full": "Zn2 Pd1 Rh1",
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"spacegroup": 225
},
{
"id": "jvasp-37635",
"created_at": "2022-09-04T14:37:55.226145Z",
"updated_at": "2022-09-04T14:37:55.226162Z",
"structure_string": "Zn2 Pd1 Pt1\n1.0\n0.000000 3.075551 3.075551\n3.075551 -0.000000 3.075551\n3.075551 3.075551 0.000000\nZn Pd Pt\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Zn\n0.250000 0.250000 0.250000 Pd\n0.750000 0.750000 0.750000 Pt\n",
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},
{
"id": "jvasp-59756",
"created_at": "2022-09-04T14:38:34.321188Z",
"updated_at": "2022-09-04T14:38:34.321220Z",
"structure_string": "Zn4 Pd2 O8\n1.0\n5.294693 0.000000 3.056893\n1.764897 4.991885 3.056893\n0.000000 -0.000000 6.113786\nZn Pd O\n4 2 8\ndirect\n0.500000 0.500000 0.500000 Zn\n0.500000 0.500000 -0.000000 Zn\n0.500000 -0.000000 0.500000 Zn\n0.000000 0.500000 0.500000 Zn\n0.875000 0.874999 0.875000 Pd\n0.125000 0.125000 0.125000 Pd\n0.740836 0.740835 0.740835 O\n0.259165 0.259164 0.722505 O\n0.259165 0.722504 0.259164 O\n0.722505 0.259164 0.259165 O\n0.740835 0.277495 0.740836 O\n0.277495 0.740835 0.740836 O\n0.259165 0.259164 0.259165 O\n0.740836 0.740835 0.277495 O\n",
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"formula_full": "Zn4 Pd2 O8",
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"spacegroup": 227
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{
"id": "jvasp-79366",
"created_at": "2022-09-04T14:36:38.894944Z",
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"formula_full": "Zn2 Pd1 Au1",
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"formula_anonymous": "ABC2",
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"spacegroup": 225
}
]
}