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{
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"results": [
{
"id": "mp-1097270",
"created_at": "2022-09-04T14:46:14.343752Z",
"structure_string": "Y2 Ru1 Pt1\n1.0\n-5.001889 5.935916 8.392555\n5.001889 -5.935916 8.392555\n5.001889 5.935916 -8.392555\nY Ru Pt\n2 1 1\ndirect\n0.000000 0.236618 0.236618 Y\n0.000000 0.763382 0.763382 Y\n0.000000 0.000000 0.000000 Ru\n0.000000 0.500000 0.500000 Pt\n",
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{
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"updated_at": "2021-11-28T01:37:52.586000Z",
"spacegroup": 71
},
{
"id": "mp-1096133",
"created_at": "2022-09-04T14:45:43.063326Z",
"structure_string": "Mg1 V1 Ru2\n1.0\n-4.761351 5.975253 8.748090\n4.761351 -5.975253 8.748090\n4.761351 5.975253 -8.748090\nMg V Ru\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.000000 0.500000 0.500000 V\n0.000000 0.285315 0.285315 Ru\n0.000000 0.714685 0.714685 Ru\n",
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"density": 0.46267356609350613,
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"volume": 995.5423295229955,
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"formula_full": "Mg1 V1 Ru2",
"formula_reduced": "MgVRu2",
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"energy": -17.98356757,
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"energy_uncorrected": -17.98356757,
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"is_magnetic": true,
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"updated_at": "2021-11-28T01:37:15.094000Z",
"spacegroup": 71
},
{
"id": "mp-1097314",
"created_at": "2022-09-04T14:45:53.636626Z",
"structure_string": "Mn1 Ga1 Fe2\n1.0\n5.780791 9.916800 0.000000\n-5.780791 9.916800 0.000000\n0.000000 4.613663 8.681599\nMn Ga Fe\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Ga\n0.000184 0.000184 0.255734 Fe\n0.999816 0.999816 0.744266 Fe\n",
"nsites": 4,
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"chemical_system": "Fe-Ga-Mn",
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"volume": 995.3791521378758,
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"formula_full": "Mn1 Ga1 Fe2",
"formula_reduced": "MnGaFe2",
"formula_anonymous": "ABC2",
"energy": -18.60783011,
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"energy_uncorrected": -18.60783011,
"band_gap": 0.0,
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"updated_at": "2021-11-28T01:37:10.175000Z",
"spacegroup": 12
},
{
"id": "mp-1208187",
"created_at": "2022-09-04T14:47:39.394222Z",
"structure_string": "Zn1 Sn3 F6\n1.0\n11.886832 0.000000 0.000000\n5.708255 10.875662 0.000000\n1.966927 0.834988 19.229041\nZn Sn F\n1 3 6\ndirect\n0.000000 0.000000 0.000000 Zn\n0.000000 0.000000 0.500000 Sn\n0.000000 0.500000 0.000000 Sn\n0.500000 0.500000 0.000000 Sn\n0.605380 0.400616 0.915303 F\n0.394620 0.599384 0.084697 F\n0.003816 0.920088 0.598389 F\n0.996184 0.079912 0.401611 F\n0.917826 0.688291 0.004478 F\n0.082174 0.311709 0.995522 F\n",
"nsites": 10,
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"elements": [
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"density": 0.35772803677312953,
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"volume": 2485.875946198704,
"volume_molar": 149.7029485990678,
"formula_full": "Zn1 Sn3 F6",
"formula_reduced": "ZnSn3F6",
"formula_anonymous": "AB3C6",
"energy": -38.9901644,
"energy_per_atom": -3.8990164399999996,
"energy_above_hull": null,
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"updated_at": "2021-11-28T01:38:12.123000Z",
"spacegroup": 2
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{
"id": "mp-1213541",
"created_at": "2022-09-04T14:39:16.647780Z",
"structure_string": "Na1 Mo3 O6\n1.0\n4.023701 -7.024615 0.000000\n4.023701 7.024615 0.000000\n0.000000 0.000000 43.974061\nNa Mo O\n1 3 6\ndirect\n0.000000 0.000000 0.000000 Na\n0.000000 0.000000 0.500000 Mo\n0.500000 0.000000 0.000000 Mo\n0.000000 0.500000 0.000000 Mo\n0.000000 0.000000 0.245249 O\n0.000000 0.000000 0.754751 O\n0.317489 0.067141 0.000000 O\n0.682511 0.932859 0.000000 O\n0.067141 0.317489 0.000000 O\n0.932859 0.682511 0.000000 O\n",
"nsites": 10,
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"Mo",
"O"
],
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"density": 0.27174516772279117,
"density_atomic": 0.00402276999470875,
"volume": 2485.8493061132626,
"volume_molar": 149.70134429562395,
"formula_full": "Na1 Mo3 O6",
"formula_reduced": "Na(MoO2)3",
"formula_anonymous": "AB3C6",
"energy": -59.63271848,
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"updated_at": "2021-11-28T01:34:31.025000Z",
"spacegroup": 65
},
{
"id": "mp-1097336",
"created_at": "2022-09-04T14:45:27.889433Z",
"structure_string": "V1 Cr2 Re1\n1.0\n-5.072761 5.840876 8.388215\n5.072761 -5.840876 8.388215\n5.072761 5.840876 -8.388215\nV Cr Re\n1 2 1\ndirect\n0.000000 0.000000 0.000000 V\n0.000000 0.275233 0.275233 Cr\n0.000000 0.724767 0.724767 Cr\n0.000000 0.500000 0.500000 Re\n",
"nsites": 4,
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"elements": [
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"Cr",
"Re"
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"density": 0.5698108325996025,
"density_atomic": 0.004023537551131776,
"volume": 994.1500356756567,
"volume_molar": 149.67278628494566,
"formula_full": "V1 Cr2 Re1",
"formula_reduced": "VCr2Re",
"formula_anonymous": "ABC2",
"energy": -25.27551392,
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"updated_at": "2021-11-28T01:37:01.619000Z",
"spacegroup": 71
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{
"id": "mp-1096305",
"created_at": "2022-09-04T14:48:12.605421Z",
"structure_string": "Hf1 Zr1 Au2\n1.0\n-5.377714 5.775218 8.001893\n5.377714 -5.775218 8.001893\n5.377714 5.775218 -8.001893\nHf Zr Au\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Hf\n0.000000 0.000000 0.000000 Zr\n0.000000 0.255681 0.255681 Au\n0.000000 0.744319 0.744319 Au\n",
"nsites": 4,
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"Zr",
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],
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"density": 1.108581197061355,
"density_atomic": 0.004023844379119358,
"volume": 994.0742293009413,
"volume_molar": 149.66137336846964,
"formula_full": "Hf1 Zr1 Au2",
"formula_reduced": "HfZrAu2",
"formula_anonymous": "ABC2",
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"updated_at": "2021-11-28T01:38:40.082000Z",
"spacegroup": 71
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{
"id": "mp-1097131",
"created_at": "2022-09-04T14:44:54.369516Z",
"structure_string": "Na1 Cd2 Rh1\n1.0\n-5.667862 5.727693 7.653738\n5.667862 -5.727693 7.653738\n5.667862 5.727693 -7.653738\nNa Cd Rh\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.000000 0.268094 0.268094 Cd\n0.000000 0.731906 0.731906 Cd\n0.000000 0.500000 0.500000 Rh\n",
"nsites": 4,
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"Rh"
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"density": 0.5859676847369844,
"density_atomic": 0.004024643424900351,
"volume": 993.876867513807,
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"formula_full": "Na1 Cd2 Rh1",
"formula_reduced": "NaCd2Rh",
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"updated_at": "2021-11-28T01:36:46.316000Z",
"spacegroup": 71
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{
"id": "mp-1093730",
"created_at": "2022-09-04T14:43:53.693071Z",
"structure_string": "Cd1 Rh2 Pb1\n1.0\n-5.256289 5.782530 8.172820\n5.256289 -5.782530 8.172820\n5.256289 5.782530 -8.172820\nCd Rh Pb\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Cd\n0.000000 0.258840 0.258840 Rh\n0.000000 0.741160 0.741160 Rh\n0.000000 0.500000 0.500000 Pb\n",
"nsites": 4,
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"volume": 993.6399754414513,
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"formula_full": "Cd1 Rh2 Pb1",
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{
"id": "mp-1093881",
"created_at": "2022-09-04T14:44:15.360204Z",
"structure_string": "Ca1 In1 Rh2\n1.0\n-5.033606 5.899004 8.359301\n5.033606 -5.899004 8.359301\n5.033606 5.899004 -8.359301\nCa In Rh\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.000000 0.500000 0.500000 In\n0.000000 0.245304 0.245304 Rh\n0.000000 0.754696 0.754696 Rh\n",
"nsites": 4,
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"volume": 992.8596565261466,
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"formula_full": "Ca1 In1 Rh2",
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"energy": -12.12431968,
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"spacegroup": 71
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{
"id": "mp-1096169",
"created_at": "2022-09-04T14:42:45.237897Z",
"structure_string": "Cd2 Ag1 Pt1\n1.0\n-5.263255 5.767331 8.175663\n5.263255 -5.767331 8.175663\n5.263255 5.767331 -8.175663\nCd Ag Pt\n2 1 1\ndirect\n0.000000 0.253071 0.253071 Cd\n0.000000 0.746929 0.746929 Cd\n0.000000 0.000000 0.000000 Ag\n0.000000 0.500000 0.500000 Pt\n",
"nsites": 4,
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"density": 0.8828460773536277,
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"volume": 992.6868340068754,
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"formula_full": "Cd2 Ag1 Pt1",
"formula_reduced": "Cd2AgPt",
"formula_anonymous": "ABC2",
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"updated_at": "2021-11-28T01:35:55.950000Z",
"spacegroup": 71
}
]
}