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{
"count": 146323,
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"results": [
{
"id": "mp-27189",
"created_at": "2022-09-04T14:41:26.767860Z",
"structure_string": "Si12 Cl32\n1.0\n0.000000 9.144231 9.144231\n9.144231 0.000000 9.144231\n9.144231 9.144231 0.000000\nSi Cl\n12 32\ndirect\n0.000000 0.000000 0.000000 Si\n0.500000 0.500000 0.500000 Si\n0.175350 0.175350 0.175350 Si\n0.973950 0.675350 0.675350 Si\n0.675350 0.973950 0.675350 Si\n0.675350 0.675350 0.973950 Si\n0.175350 0.473950 0.175350 Si\n0.175350 0.175350 0.473950 Si\n0.473950 0.175350 0.175350 Si\n0.675350 0.675350 0.675350 Si\n0.250000 0.250000 0.250000 Si\n0.750000 0.750000 0.750000 Si\n0.935795 0.935795 0.935795 Cl\n0.692615 0.435795 0.435795 Cl\n0.435795 0.692615 0.435795 Cl\n0.435795 0.435795 0.692615 Cl\n0.935795 0.192615 0.935795 Cl\n0.935795 0.935795 0.192615 Cl\n0.192615 0.935795 0.935795 Cl\n0.435795 0.435795 0.435795 Cl\n0.284180 0.991516 0.183158 Cl\n0.041146 0.683158 0.784180 Cl\n0.683158 0.041146 0.491516 Cl\n0.491516 0.683158 0.041146 Cl\n0.041146 0.784180 0.491516 Cl\n0.683158 0.784180 0.041146 Cl\n0.491516 0.041146 0.784180 Cl\n0.183158 0.284180 0.991516 Cl\n0.991516 0.183158 0.284180 Cl\n0.284180 0.541146 0.991516 Cl\n0.284180 0.183158 0.541146 Cl\n0.991516 0.541146 0.183158 Cl\n0.541146 0.284180 0.183158 Cl\n0.541146 0.991516 0.284180 Cl\n0.183158 0.991516 0.541146 Cl\n0.991516 0.284180 0.541146 Cl\n0.183158 0.541146 0.284180 Cl\n0.541146 0.183158 0.991516 Cl\n0.784180 0.041146 0.683158 Cl\n0.784180 0.491516 0.041146 Cl\n0.041146 0.491516 0.683158 Cl\n0.784180 0.683158 0.491516 Cl\n0.491516 0.784180 0.683158 Cl\n0.683158 0.491516 0.784180 Cl\n",
"nsites": 44,
"nelements": 2,
"elements": [
"Si",
"Cl"
],
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"density": 1.597880494897578,
"density_atomic": 0.028772732959161385,
"volume": 1529.2256061477183,
"volume_molar": 20.93002694094973,
"formula_full": "Si12 Cl32",
"formula_reduced": "Si3Cl8",
"formula_anonymous": "A3B8",
"energy": -193.22115874,
"energy_per_atom": -4.391389971363636,
"energy_above_hull": null,
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"energy_uncorrected": -173.57315874,
"band_gap": 4.7516,
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"is_theoretical": false,
"updated_at": "2021-11-28T01:35:21.316000Z",
"spacegroup": 219
},
{
"id": "mp-1237338",
"created_at": "2022-09-04T14:42:24.899478Z",
"structure_string": "Rb3 Bi1 F6\n1.0\n7.264968 0.000000 0.000000\n-1.612664 7.103835 0.000000\n-2.711634 -2.000613 6.734337\nRb Bi F\n3 1 6\ndirect\n0.000000 0.500000 0.000000 Rb\n0.500000 0.000000 0.000000 Rb\n0.000000 0.000000 0.500000 Rb\n0.000000 0.000000 0.000000 Bi\n0.019314 0.770486 0.762673 F\n0.980686 0.229514 0.237327 F\n0.789634 0.782358 0.084724 F\n0.210366 0.217642 0.915276 F\n0.739739 0.085455 0.790671 F\n0.260261 0.914545 0.209329 F\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Rb",
"Bi",
"F"
],
"chemical_system": "Bi-F-Rb",
"density": 2.7681323247300846,
"density_atomic": 0.028772565218054533,
"volume": 347.55330031279544,
"volume_molar": 20.93014896086206,
"formula_full": "Rb3 Bi1 F6",
"formula_reduced": "Rb3BiF6",
"formula_anonymous": "AB3C6",
"energy": -46.48050713,
"energy_per_atom": -4.648050713,
"energy_above_hull": null,
"is_stable": null,
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"energy_uncorrected": -43.70850713,
"band_gap": 4.4997,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:35:43.234000Z",
"spacegroup": 2
},
{
"id": "mp-667387",
"created_at": "2022-09-04T14:42:44.005634Z",
"structure_string": "Hg32 Br12 O16\n1.0\n6.488584 0.000000 0.000000\n0.000000 7.775780 0.000000\n0.000000 3.138873 41.332346\nHg Br O\n32 12 16\ndirect\n0.832545 0.369086 0.713800 Hg\n0.306434 0.744871 0.699910 Hg\n0.639567 0.209768 0.885862 Hg\n0.055078 0.067859 0.671241 Hg\n0.332545 0.630914 0.786200 Hg\n0.930155 0.895953 0.154209 Hg\n0.212028 0.396499 0.609365 Hg\n0.860433 0.209768 0.385862 Hg\n0.069845 0.104047 0.845791 Hg\n0.360433 0.790232 0.114138 Hg\n0.787972 0.603501 0.390635 Hg\n0.444922 0.067859 0.171241 Hg\n0.555078 0.932141 0.828759 Hg\n0.430155 0.104047 0.345791 Hg\n0.689847 0.031259 0.989581 Hg\n0.810153 0.031259 0.489581 Hg\n0.274039 0.114062 0.257869 Hg\n0.725961 0.885938 0.742131 Hg\n0.310153 0.968741 0.010419 Hg\n0.806434 0.255129 0.800090 Hg\n0.569845 0.895953 0.654209 Hg\n0.139567 0.790232 0.614138 Hg\n0.667455 0.369086 0.213800 Hg\n0.693566 0.255129 0.300090 Hg\n0.225961 0.114062 0.757869 Hg\n0.774039 0.885938 0.242131 Hg\n0.944922 0.932141 0.328759 Hg\n0.189847 0.968741 0.510419 Hg\n0.712028 0.603501 0.890635 Hg\n0.193566 0.744871 0.199910 Hg\n0.287972 0.396499 0.109365 Hg\n0.167455 0.630914 0.286200 Hg\n0.259463 0.827995 0.385381 Br\n0.490108 0.134153 0.457423 Br\n0.652250 0.618583 0.297429 Br\n0.009892 0.134153 0.957423 Br\n0.240537 0.827995 0.885381 Br\n0.509892 0.865847 0.542577 Br\n0.740537 0.172005 0.614619 Br\n0.152250 0.381417 0.202571 Br\n0.347750 0.381417 0.702571 Br\n0.990108 0.865847 0.042577 Br\n0.759463 0.172005 0.114619 Br\n0.847750 0.618583 0.797429 Br\n0.121091 0.849438 0.252905 O\n0.049076 0.717977 0.909627 O\n0.833127 0.618675 0.689527 O\n0.166873 0.381325 0.310473 O\n0.059368 0.271402 0.290376 O\n0.878909 0.150562 0.747095 O\n0.549076 0.282023 0.590373 O\n0.666873 0.618675 0.189527 O\n0.333127 0.381325 0.810473 O\n0.940632 0.728598 0.709624 O\n0.950924 0.282023 0.090373 O\n0.559368 0.728598 0.209624 O\n0.621091 0.150562 0.247095 O\n0.378909 0.849438 0.752905 O\n0.440632 0.271402 0.790376 O\n0.450924 0.717977 0.409627 O\n",
"nsites": 60,
"nelements": 3,
"elements": [
"Hg",
"Br",
"O"
],
"chemical_system": "Br-Hg-O",
"density": 6.078568014823129,
"density_atomic": 0.028771817585371423,
"volume": 2085.3739886946196,
"volume_molar": 20.930692828602748,
"formula_full": "Hg32 Br12 O16",
"formula_reduced": "Hg8Br3O4",
"formula_anonymous": "A3B4C8",
"energy": -119.44665613,
"energy_per_atom": -1.9907776021666665,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -110.46265613,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0806511,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:55.283000Z",
"spacegroup": 14
},
{
"id": "mp-1221670",
"created_at": "2022-09-04T14:39:22.643333Z",
"structure_string": "Mn1 Cd1 Hg1 Te3\n1.0\n-3.275253 -3.275253 0.000000\n-0.004697 0.004697 -6.506811\n6.532601 -3.257346 3.260437\nMn Cd Hg Te\n1 1 1 3\ndirect\n0.333569 0.329798 0.667138 Mn\n0.998726 0.999355 0.997453 Cd\n0.667649 0.668867 0.335296 Hg\n0.493295 0.735707 0.986591 Te\n0.172801 0.412157 0.345602 Te\n0.833960 0.104115 0.667921 Te\n",
"nsites": 6,
"nelements": 4,
"elements": [
"Mn",
"Cd",
"Hg",
"Te"
],
"chemical_system": "Cd-Hg-Mn-Te",
"density": 5.977967925285912,
"density_atomic": 0.02877177993368747,
"volume": 208.53767176826256,
"volume_molar": 20.93072021918592,
"formula_full": "Mn1 Cd1 Hg1 Te3",
"formula_reduced": "MnCdHgTe3",
"formula_anonymous": "ABCD3",
"energy": -22.509065560000003,
"energy_per_atom": -3.751510926666667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -21.24306556,
"band_gap": 0.0405000000000002,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 4.9996969,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:25.725000Z",
"spacegroup": 8
},
{
"id": "mp-1185135",
"created_at": "2022-09-04T14:47:24.473685Z",
"structure_string": "K2 Br6\n1.0\n3.225455 -5.586652 0.000000\n3.225455 5.586652 0.000000\n0.000000 0.000000 7.715533\nK Br\n2 6\ndirect\n0.666667 0.333333 0.250000 K\n0.333333 0.666667 0.750000 K\n0.832619 0.167381 0.750000 Br\n0.334761 0.167381 0.750000 Br\n0.832619 0.665239 0.750000 Br\n0.167381 0.832619 0.250000 Br\n0.665239 0.832619 0.250000 Br\n0.167381 0.334761 0.250000 Br\n",
"nsites": 8,
"nelements": 2,
"elements": [
"K",
"Br"
],
"chemical_system": "Br-K",
"density": 3.330039395962333,
"density_atomic": 0.028770767774018057,
"volume": 278.06001087063584,
"volume_molar": 20.93145656487624,
"formula_full": "K2 Br6",
"formula_reduced": "KBr3",
"formula_anonymous": "AB3",
"energy": -20.29644578,
"energy_per_atom": -2.5370557225,
"energy_above_hull": null,
"is_stable": null,
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"energy_uncorrected": -17.09244578,
"band_gap": 0.0,
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"total_magnetization": 0.0001844,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:04.802000Z",
"spacegroup": 194
},
{
"id": "mp-1238818",
"created_at": "2022-09-04T14:39:09.338528Z",
"structure_string": "Ti6\n1.0\n-1.464038 -2.535788 0.000000\n-1.464039 2.535788 0.000000\n0.000000 0.000000 -28.087341\nTi\n6\ndirect\n0.666667 0.333333 0.704382 Ti\n0.333333 0.666667 0.626464 Ti\n0.666667 0.333333 0.540896 Ti\n0.333333 0.666667 0.459104 Ti\n0.666667 0.333333 0.373536 Ti\n0.333333 0.666667 0.295618 Ti\n",
"nsites": 6,
"nelements": 1,
"elements": [
"Ti"
],
"chemical_system": "Ti",
"density": 2.2868121704973263,
"density_atomic": 0.02877035282590335,
"volume": 208.54801594917902,
"volume_molar": 20.93175845441135,
"formula_full": "Ti6",
"formula_reduced": "Ti",
"formula_anonymous": "A",
"energy": -45.51110526,
"energy_per_atom": -7.58518421,
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"energy_uncorrected": -45.51110526,
"band_gap": 0.0,
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"is_magnetic": true,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:34:35.168000Z",
"spacegroup": 164
},
{
"id": "mp-16475",
"created_at": "2022-09-04T14:43:16.321018Z",
"structure_string": "Sr22 Sb20\n1.0\n-6.283637 6.283637 9.243327\n6.283637 -6.283637 9.243327\n6.283637 6.283637 -9.243327\nSr Sb\n22 20\ndirect\n0.810277 0.060621 0.250344 Sr\n0.810277 0.559933 0.749656 Sr\n0.060621 0.810277 0.250344 Sr\n0.559933 0.810277 0.749656 Sr\n0.189723 0.939379 0.749656 Sr\n0.189723 0.440067 0.250344 Sr\n0.939379 0.189723 0.749656 Sr\n0.440067 0.189723 0.250344 Sr\n0.169106 0.169106 0.338211 Sr\n0.830894 0.830894 0.661789 Sr\n0.169106 0.830894 0.000000 Sr\n0.830894 0.169106 0.000000 Sr\n0.655275 0.655275 0.000000 Sr\n0.344725 0.344725 0.000000 Sr\n0.604870 0.939581 0.334711 Sr\n0.604870 0.270159 0.665289 Sr\n0.939581 0.604870 0.334711 Sr\n0.270159 0.604870 0.665289 Sr\n0.395130 0.060419 0.665289 Sr\n0.395130 0.729841 0.334711 Sr\n0.060419 0.395130 0.665289 Sr\n0.729841 0.395130 0.334711 Sr\n0.353690 0.000000 0.353690 Sb\n0.646310 0.000000 0.646310 Sb\n0.000000 0.646310 0.646310 Sb\n0.000000 0.353690 0.353690 Sb\n0.878099 0.878099 0.000000 Sb\n0.121901 0.121901 0.000000 Sb\n0.378804 0.378804 0.757608 Sb\n0.621196 0.621196 0.242392 Sb\n0.378804 0.621196 0.000000 Sb\n0.621196 0.378804 0.000000 Sb\n0.750000 0.250000 0.500000 Sb\n0.250000 0.750000 0.500000 Sb\n0.889089 0.889089 0.419472 Sb\n0.469617 0.469617 0.580528 Sb\n0.889089 0.469617 0.000000 Sb\n0.469617 0.889089 0.000000 Sb\n0.110911 0.110911 0.580528 Sb\n0.530383 0.530383 0.419472 Sb\n0.110911 0.530383 0.000000 Sb\n0.530383 0.110911 0.000000 Sb\n",
"nsites": 42,
"nelements": 2,
"elements": [
"Sr",
"Sb"
],
"chemical_system": "Sb-Sr",
"density": 4.962584314331517,
"density_atomic": 0.02876992999865247,
"volume": 1459.8575666317993,
"volume_molar": 20.932066085256604,
"formula_full": "Sr22 Sb20",
"formula_reduced": "Sr11Sb10",
"formula_anonymous": "A10B11",
"energy": -164.59697942,
"energy_per_atom": -3.9189757004761905,
"energy_above_hull": null,
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"energy_uncorrected": -160.75697942,
"band_gap": 0.0,
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"total_magnetization": 0.9029393,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:17.340000Z",
"spacegroup": 139
},
{
"id": "mp-30283",
"created_at": "2022-09-04T14:46:59.975747Z",
"structure_string": "Tb8 Si2 Br12\n1.0\n4.079184 0.000000 0.000000\n0.000000 13.312560 0.000000\n0.000000 0.000000 14.082909\nTb Si Br\n8 2 12\ndirect\n0.500000 0.118392 0.340897 Tb\n0.500000 0.881608 0.659103 Tb\n0.500000 0.618392 0.159103 Tb\n0.500000 0.381608 0.840897 Tb\n0.000000 0.117998 0.578199 Tb\n0.000000 0.882002 0.421801 Tb\n0.000000 0.617998 0.921801 Tb\n0.000000 0.382002 0.078199 Tb\n0.500000 0.000000 0.500000 Si\n0.500000 0.500000 0.000000 Si\n0.500000 0.243705 0.162313 Br\n0.500000 0.756295 0.837687 Br\n0.500000 0.743705 0.337687 Br\n0.500000 0.256295 0.662313 Br\n0.000000 0.255079 0.411437 Br\n0.000000 0.744921 0.588563 Br\n0.000000 0.755079 0.088563 Br\n0.000000 0.244921 0.911437 Br\n0.000000 0.001537 0.243480 Br\n0.000000 0.998463 0.756520 Br\n0.000000 0.501537 0.256520 Br\n0.000000 0.498463 0.743480 Br\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Tb",
"Si",
"Br"
],
"chemical_system": "Br-Si-Tb",
"density": 4.964530727506977,
"density_atomic": 0.02876705701860997,
"volume": 764.7636665011569,
"volume_molar": 20.93415658092574,
"formula_full": "Tb8 Si2 Br12",
"formula_reduced": "Tb4SiBr6",
"formula_anonymous": "AB4C6",
"energy": -109.31456674,
"energy_per_atom": -4.968843942727273,
"energy_above_hull": null,
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"updated_at": "2021-11-28T01:37:45.250000Z",
"spacegroup": 55
},
{
"id": "mp-1189209",
"created_at": "2022-09-04T14:44:31.149997Z",
"structure_string": "Ho8 Te12\n1.0\n0.000000 6.117316 13.099065\n4.338431 0.000000 13.099065\n4.338431 6.117316 0.000000\nHo Te\n8 12\ndirect\n0.332728 0.332728 0.167272 Ho\n0.167272 0.167272 0.332728 Ho\n0.917272 0.917272 0.082728 Ho\n0.082728 0.082728 0.917272 Ho\n0.999940 0.999940 0.500060 Ho\n0.500060 0.500060 0.999940 Ho\n0.250060 0.250060 0.749940 Ho\n0.749940 0.749940 0.250060 Ho\n0.997400 0.502600 0.502600 Te\n0.502600 0.997400 0.997400 Te\n0.252600 0.747400 0.747400 Te\n0.747400 0.252600 0.252600 Te\n0.665963 0.168166 0.833092 Te\n0.833092 0.332779 0.665963 Te\n0.332779 0.833092 0.168166 Te\n0.168166 0.665963 0.332779 Te\n0.584037 0.081834 0.416908 Te\n0.416908 0.917221 0.584037 Te\n0.917221 0.416908 0.081834 Te\n0.081834 0.584037 0.917221 Te\n",
"nsites": 20,
"nelements": 2,
"elements": [
"Ho",
"Te"
],
"chemical_system": "Ho-Te",
"density": 6.808131874793778,
"density_atomic": 0.02876511355869141,
"volume": 695.2866693605309,
"volume_molar": 20.93557095720349,
"formula_full": "Ho8 Te12",
"formula_reduced": "Ho2Te3",
"formula_anonymous": "A2B3",
"energy": -107.38754786,
"energy_per_atom": -5.369377393,
"energy_above_hull": null,
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"energy_uncorrected": -102.32354786,
"band_gap": 0.5307999999999997,
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"updated_at": "2021-11-28T01:36:40.426000Z",
"spacegroup": 70
},
{
"id": "mp-568008",
"created_at": "2022-09-04T14:40:13.381225Z",
"structure_string": "Rb3 Mn2 Cl7\n1.0\n-2.424759 2.424759 17.739239\n2.424759 -2.424759 17.739239\n2.424759 2.424759 -17.739239\nRb Mn Cl\n3 2 7\ndirect\n0.176920 0.176920 0.000000 Rb\n0.823080 0.823080 0.000000 Rb\n0.500000 0.500000 0.000000 Rb\n0.376396 0.376396 0.000000 Mn\n0.623604 0.623604 0.000000 Mn\n0.691951 0.691951 0.000000 Cl\n0.609970 0.109970 0.500000 Cl\n0.890030 0.390030 0.500000 Cl\n0.390030 0.890030 0.500000 Cl\n0.308049 0.308049 0.000000 Cl\n0.000000 0.000000 0.000000 Cl\n0.109970 0.609970 0.500000 Cl\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Rb",
"Mn",
"Cl"
],
"chemical_system": "Cl-Mn-Rb",
"density": 2.445703787292563,
"density_atomic": 0.028763988719932288,
"volume": 417.18831546073034,
"volume_molar": 20.936389659431686,
"formula_full": "Rb3 Mn2 Cl7",
"formula_reduced": "Rb3Mn2Cl7",
"formula_anonymous": "A2B3C7",
"energy": -55.67083688,
"energy_per_atom": -4.639236406666667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -51.37283688000001,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 10.0009318,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:54.828000Z",
"spacegroup": 139
},
{
"id": "mp-980034",
"created_at": "2022-09-04T14:41:28.130731Z",
"structure_string": "Yb3 Mg1\n1.0\n0.000000 4.112160 4.112160\n4.112160 0.000000 4.112160\n4.112160 4.112160 0.000000\nYb Mg\n3 1\ndirect\n0.250000 0.250000 0.250000 Yb\n0.500000 0.500000 0.500000 Yb\n0.750000 0.750000 0.750000 Yb\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Yb",
"Mg"
],
"chemical_system": "Mg-Yb",
"density": 6.488565648811588,
"density_atomic": 0.028762059663171635,
"volume": 139.0720986898514,
"volume_molar": 20.937793852472417,
"formula_full": "Yb3 Mg1",
"formula_reduced": "Yb3Mg",
"formula_anonymous": "AB3",
"energy": -6.09485699,
"energy_per_atom": -1.5237142475,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -6.09485699,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 5.73e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:14.875000Z",
"spacegroup": 225
},
{
"id": "mp-1114078",
"created_at": "2022-09-04T14:46:22.560560Z",
"structure_string": "Rb2 Y1 Hg1 Cl6\n1.0\n0.000000 5.581141 5.581141\n5.581141 0.000000 5.581141\n5.581141 5.581141 0.000000\nRb Y Hg Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.500000 Hg\n0.763598 0.236402 0.236402 Cl\n0.236402 0.236402 0.763598 Cl\n0.236402 0.763598 0.763598 Cl\n0.236402 0.763598 0.236402 Cl\n0.763598 0.236402 0.763598 Cl\n0.763598 0.763598 0.236402 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Y",
"Hg",
"Cl"
],
"chemical_system": "Cl-Hg-Rb-Y",
"density": 3.2148566571445985,
"density_atomic": 0.028760803888703085,
"volume": 347.6954273843467,
"volume_molar": 20.938708053168945,
"formula_full": "Rb2 Y1 Hg1 Cl6",
"formula_reduced": "Rb2YHgCl6",
"formula_anonymous": "ABC2D6",
"energy": -40.61328163,
"energy_per_atom": -4.061328163000001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -36.92928163,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.8870538,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:33.410000Z",
"spacegroup": 225
}
]
}