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{
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"results": [
{
"id": "mp-1245869",
"created_at": "2022-09-04T14:43:55.660722Z",
"structure_string": "Sn1 C1 N2\n1.0\n3.903257 0.000020 -0.000017\n1.951647 5.190839 -0.097469\n0.000037 14.900859 3.020549\nSn C N\n1 1 2\ndirect\n0.000000 0.999920 0.000018 Sn\n0.000000 0.999995 0.499993 C\n0.000000 0.999995 0.418393 N\n0.000000 0.999990 0.581597 N\n",
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{
"id": "mp-1026423",
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"structure_string": "Mg14 Ga1 Bi1\n1.0\n6.395744 0.000000 -0.000000\n-3.197872 5.538876 0.000000\n-0.000000 -0.000000 10.335076\nMg Ga Bi\n14 1 1\ndirect\n0.165862 0.832931 0.125000 Mg\n0.166095 0.833047 0.625000 Mg\n0.667069 0.334138 0.125000 Mg\n0.666953 0.333905 0.625000 Mg\n0.667069 0.832931 0.125000 Mg\n0.666953 0.833047 0.625000 Mg\n0.335434 0.164566 0.369679 Mg\n0.335434 0.164566 0.880321 Mg\n0.335434 0.670870 0.369679 Mg\n0.335434 0.670870 0.880321 Mg\n0.829130 0.164566 0.369679 Mg\n0.829130 0.164566 0.880321 Mg\n0.833333 0.666667 0.375760 Mg\n0.833333 0.666667 0.874240 Mg\n0.166667 0.333333 0.125000 Ga\n0.166667 0.333333 0.625000 Bi\n",
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"elements": [
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"volume": 366.122474791298,
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"formula_full": "Mg14 Ga1 Bi1",
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{
"id": "mp-1206609",
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"structure_string": "Mn2 V1 In1\n1.0\n0.000000 3.125600 3.125600\n3.125600 0.000000 3.125600\n3.125600 3.125600 0.000000\nMn V In\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Mn\n0.750000 0.750000 0.750000 Mn\n0.000000 0.000000 0.000000 V\n0.500000 0.500000 0.500000 In\n",
"nsites": 4,
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"elements": [
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"chemical_system": "In-Mn-V",
"density": 7.494699077360767,
"density_atomic": 0.0654982657548774,
"volume": 61.070319250432,
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"formula_full": "Mn2 V1 In1",
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"updated_at": "2021-11-28T01:34:30.290000Z",
"spacegroup": 225
},
{
"id": "mp-623452",
"created_at": "2022-09-04T14:46:52.773077Z",
"structure_string": "Mn3 Bi1\n1.0\n-2.004908 2.004908 4.275067\n2.004908 -2.004908 4.275067\n2.004908 2.004908 -4.275067\nMn Bi\n3 1\ndirect\n0.250000 0.750000 0.500000 Mn\n0.500000 0.500000 0.000000 Mn\n0.750000 0.250000 0.500000 Mn\n0.000000 0.000000 0.000000 Bi\n",
"nsites": 4,
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"elements": [
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"chemical_system": "Bi-Mn",
"density": 9.030051572260083,
"density_atomic": 0.05819265565988243,
"volume": 68.7371963805661,
"volume_molar": 10.34862680128829,
"formula_full": "Mn3 Bi1",
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"energy": -29.80158131,
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"updated_at": "2021-11-28T01:37:37.879000Z",
"spacegroup": 139
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{
"id": "mp-1184577",
"created_at": "2022-09-04T14:41:13.606228Z",
"structure_string": "Ho2 Os1 Rh1\n1.0\n0.000000 3.403752 3.403752\n3.403752 0.000000 3.403752\n3.403752 3.403752 0.000000\nHo Os Rh\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ho\n0.750000 0.750000 0.750000 Ho\n0.500000 0.500000 0.500000 Os\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 4,
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"density": 13.116885545989133,
"density_atomic": 0.05071731655868935,
"volume": 78.86852600671918,
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"formula_full": "Ho2 Os1 Rh1",
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"formula_anonymous": "ABC2",
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"updated_at": "2021-11-28T01:35:16.345000Z",
"spacegroup": 225
},
{
"id": "mp-1246964",
"created_at": "2022-09-04T14:43:50.956865Z",
"structure_string": "Pt1 C1 N2\n1.0\n5.072773 0.069691 0.043881\n3.906584 3.236738 0.043881\n3.906584 1.438504 2.899846\nPt C N\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Pt\n0.500000 0.500000 0.500000 C\n0.589056 0.589056 0.589056 N\n0.410944 0.410944 0.410944 N\n",
"nsites": 4,
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"elements": [
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"C",
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"density": 8.449026018120398,
"density_atomic": 0.08656651809717625,
"volume": 46.2072414130109,
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"formula_full": "Pt1 C1 N2",
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"formula_anonymous": "ABC2",
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"total_magnetization": 5.7e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:29.888000Z",
"spacegroup": 166
},
{
"id": "mp-1187057",
"created_at": "2022-09-04T14:40:52.389403Z",
"structure_string": "Th3 Rh1\n1.0\n-2.258281 2.258281 5.305796\n2.258281 -2.258281 5.305796\n2.258281 2.258281 -5.305796\nTh Rh\n3 1\ndirect\n0.750000 0.250000 0.500000 Th\n0.250000 0.750000 0.500000 Th\n0.500000 0.500000 0.000000 Th\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 4,
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"density": 12.258577388757539,
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"volume": 108.23469571918311,
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"formula_full": "Th3 Rh1",
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"updated_at": "2021-11-28T01:35:01.260000Z",
"spacegroup": 139
},
{
"id": "mp-1027787",
"created_at": "2022-09-04T14:47:58.912634Z",
"structure_string": "Na1 Mg14 Fe1\n1.0\n6.399148 -0.000000 -0.000000\n-3.199574 5.541824 0.000000\n0.000000 -0.000000 9.985900\nNa Mg Fe\n1 14 1\ndirect\n0.166667 0.333333 0.625000 Na\n0.159646 0.829822 0.125000 Mg\n0.174109 0.837054 0.625000 Mg\n0.670178 0.340354 0.125000 Mg\n0.662946 0.325891 0.625000 Mg\n0.670178 0.829822 0.125000 Mg\n0.662946 0.837054 0.625000 Mg\n0.326574 0.173426 0.355582 Mg\n0.326574 0.173426 0.894418 Mg\n0.326574 0.653149 0.355582 Mg\n0.326574 0.653149 0.894418 Mg\n0.846851 0.173426 0.355582 Mg\n0.846851 0.173426 0.894418 Mg\n0.833333 0.666667 0.380375 Mg\n0.833333 0.666667 0.869625 Mg\n0.166667 0.333333 0.125000 Fe\n",
"nsites": 16,
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],
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"density": 1.9652128897400603,
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"volume": 354.1294920368001,
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"formula_full": "Na1 Mg14 Fe1",
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{
"id": "mp-754516",
"created_at": "2022-09-04T14:46:58.691361Z",
"structure_string": "Li2 Ni2 P2\n1.0\n3.737380 0.000000 0.000000\n0.000000 3.737380 0.000000\n0.000000 0.000000 5.800367\nLi Ni P\n2 2 2\ndirect\n0.000000 0.500000 0.337043 Li\n0.500000 0.000000 0.662957 Li\n0.000000 0.000000 0.000000 Ni\n0.500000 0.500000 0.000000 Ni\n0.000000 0.500000 0.780447 P\n0.500000 0.000000 0.219553 P\n",
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"volume": 81.01957999292003,
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"formula_full": "Li2 Ni2 P2",
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{
"id": "mp-20730",
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"structure_string": "Hf1 Co2 Sn1\n1.0\n0.000000 3.126353 3.126353\n3.126353 0.000000 3.126353\n3.126353 3.126353 0.000000\nHf Co Sn\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Hf\n0.250000 0.250000 0.250000 Co\n0.750000 0.750000 0.750000 Co\n0.000000 0.000000 0.000000 Sn\n",
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"volume": 61.114467922622374,
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{
"id": "mp-1025100",
"created_at": "2022-09-04T14:39:24.678390Z",
"structure_string": "La1 Ge5\n1.0\n-2.026120 3.171164 5.027820\n2.026120 -3.171164 5.027820\n2.026120 3.171164 -5.027820\nLa Ge\n1 5\ndirect\n0.000000 0.000000 0.000000 La\n0.469811 0.672073 0.797738 Ge\n0.530189 0.327927 0.202262 Ge\n0.125666 0.327927 0.797738 Ge\n0.874334 0.672073 0.202262 Ge\n0.500000 0.000000 0.500000 Ge\n",
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"updated_at": "2021-11-28T01:34:44.445000Z",
"spacegroup": 71
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{
"id": "mp-11215",
"created_at": "2022-09-04T14:46:21.422531Z",
"structure_string": "Ce2 Ag2 Ge2\n1.0\n2.287439 -3.961960 0.000000\n2.287439 3.961960 0.000000\n0.000000 0.000000 7.559184\nCe Ag Ge\n2 2 2\ndirect\n0.000000 0.000000 0.239177 Ce\n0.000000 0.000000 0.739177 Ce\n0.666667 0.333333 0.508348 Ag\n0.333333 0.666667 0.008348 Ag\n0.666667 0.333333 0.962375 Ge\n0.333333 0.666667 0.462375 Ge\n",
"nsites": 6,
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"density": 7.771607730093778,
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"volume": 137.01386593040183,
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"formula_full": "Ce2 Ag2 Ge2",
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"updated_at": "2021-11-28T01:37:30.926000Z",
"spacegroup": 186
}
]
}