HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 146323,
"next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-is_magnetic&page=12190",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-is_magnetic&page=12188",
"results": [
{
"id": "mp-1707",
"created_at": "2022-09-04T14:44:57.189751Z",
"structure_string": "Ba2 N12\n1.0\n4.442183 0.000000 0.000000\n0.000000 5.527773 0.000000\n0.000000 1.544728 9.684097\nBa N\n2 12\ndirect\n0.750000 0.170645 0.781228 Ba\n0.250000 0.829355 0.218772 Ba\n0.750000 0.708090 0.661893 N\n0.250000 0.291910 0.338107 N\n0.250000 0.859138 0.903747 N\n0.750000 0.140862 0.096253 N\n0.250000 0.648952 0.889997 N\n0.750000 0.351048 0.110003 N\n0.250000 0.440156 0.878458 N\n0.750000 0.559844 0.121542 N\n0.250000 0.221153 0.583149 N\n0.750000 0.778847 0.416851 N\n0.250000 0.256451 0.460544 N\n0.750000 0.743549 0.539456 N\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Ba",
"N"
],
"chemical_system": "Ba-N",
"density": 3.0916234166464283,
"density_atomic": 0.05887382583722285,
"volume": 237.79667451386402,
"volume_molar": 10.228893187017098,
"formula_full": "Ba2 N12",
"formula_reduced": "BaN6",
"formula_anonymous": "AB6",
"energy": -110.78955134,
"energy_per_atom": -7.9135393814285715,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -106.45755134,
"band_gap": 3.8146,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0044344,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:49.301000Z",
"spacegroup": 11
},
{
"id": "mp-1071448",
"created_at": "2022-09-04T14:44:57.193488Z",
"structure_string": "Ce2 Ga2 Co2\n1.0\n2.178044 5.435475 0.000000\n-2.178044 5.435475 0.000000\n0.000000 0.837438 4.668173\nCe Ga Co\n2 2 2\ndirect\n0.126541 0.126541 0.685635 Ce\n0.873459 0.873459 0.314365 Ce\n0.412663 0.412663 0.808709 Ga\n0.587337 0.587337 0.191291 Ga\n0.194506 0.194506 0.137911 Co\n0.805494 0.805494 0.862089 Co\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"Ga",
"Co"
],
"chemical_system": "Ce-Co-Ga",
"density": 8.075740247978983,
"density_atomic": 0.05428378988161332,
"volume": 110.53023403644637,
"volume_molar": 11.093810460053717,
"formula_full": "Ce2 Ga2 Co2",
"formula_reduced": "CeGaCo",
"formula_anonymous": "ABC",
"energy": -35.50362449,
"energy_per_atom": -5.917270748333333,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -35.50362449,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0003231,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:43.592000Z",
"spacegroup": 12
},
{
"id": "mp-31295",
"created_at": "2022-09-04T14:44:55.170644Z",
"structure_string": "La12 Sn24 Pd16\n1.0\n4.685436 0.000000 0.000000\n0.000000 15.845293 0.000000\n0.000000 0.000000 17.114872\nLa Sn Pd\n12 24 16\ndirect\n0.250000 0.881966 0.141633 La\n0.750000 0.118034 0.858367 La\n0.750000 0.381966 0.358367 La\n0.250000 0.618034 0.641633 La\n0.250000 0.017211 0.350661 La\n0.750000 0.982789 0.649339 La\n0.750000 0.517211 0.149339 La\n0.250000 0.482789 0.850661 La\n0.250000 0.751370 0.384059 La\n0.750000 0.248630 0.615941 La\n0.750000 0.251370 0.115941 La\n0.250000 0.748630 0.884059 La\n0.250000 0.582288 0.025821 Sn\n0.750000 0.417712 0.974179 Sn\n0.750000 0.082288 0.474179 Sn\n0.250000 0.917712 0.525821 Sn\n0.250000 0.105709 0.171180 Sn\n0.750000 0.894291 0.828820 Sn\n0.750000 0.605709 0.328820 Sn\n0.250000 0.394291 0.671180 Sn\n0.250000 0.663348 0.189092 Sn\n0.750000 0.336652 0.810908 Sn\n0.750000 0.163348 0.310908 Sn\n0.250000 0.836652 0.689092 Sn\n0.250000 0.379593 0.206310 Sn\n0.750000 0.620407 0.793690 Sn\n0.750000 0.879593 0.293690 Sn\n0.250000 0.120407 0.706310 Sn\n0.250000 0.229862 0.442946 Sn\n0.750000 0.770138 0.557054 Sn\n0.750000 0.729862 0.057054 Sn\n0.250000 0.270138 0.942946 Sn\n0.250000 0.538334 0.447603 Sn\n0.750000 0.461666 0.552397 Sn\n0.750000 0.038334 0.052397 Sn\n0.250000 0.961666 0.947603 Sn\n0.250000 0.121301 0.011294 Pd\n0.750000 0.878699 0.988706 Pd\n0.750000 0.621301 0.488706 Pd\n0.250000 0.378699 0.511294 Pd\n0.250000 0.400285 0.047811 Pd\n0.750000 0.599715 0.952189 Pd\n0.750000 0.900285 0.452189 Pd\n0.250000 0.099715 0.547811 Pd\n0.250000 0.233547 0.282579 Pd\n0.750000 0.766453 0.717421 Pd\n0.750000 0.733547 0.217421 Pd\n0.250000 0.266453 0.782579 Pd\n0.250000 0.525351 0.290718 Pd\n0.750000 0.474649 0.709282 Pd\n0.750000 0.025351 0.209282 Pd\n0.250000 0.974649 0.790718 Pd\n",
"nsites": 52,
"nelements": 3,
"elements": [
"La",
"Sn",
"Pd"
],
"chemical_system": "La-Pd-Sn",
"density": 8.126799979473603,
"density_atomic": 0.040924125124321475,
"volume": 1270.6441455261815,
"volume_molar": 14.715380577362671,
"formula_full": "La12 Sn24 Pd16",
"formula_reduced": "La3(Sn3Pd2)2",
"formula_anonymous": "A3B4C6",
"energy": -281.16074339,
"energy_per_atom": -5.406937372884615,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -281.16074339,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001906,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:44.253000Z",
"spacegroup": 62
},
{
"id": "mp-17730",
"created_at": "2022-09-04T14:44:55.199826Z",
"structure_string": "K8 Sn4 O12\n1.0\n5.842665 0.000000 0.000000\n0.000000 7.135220 0.000000\n0.000000 0.000000 10.544657\nK Sn O\n8 4 12\ndirect\n0.235625 0.885060 0.911895 K\n0.764375 0.114940 0.088105 K\n0.235625 0.885060 0.588105 K\n0.735625 0.614940 0.911895 K\n0.264375 0.385060 0.088105 K\n0.764375 0.114940 0.411895 K\n0.735625 0.614940 0.588105 K\n0.264375 0.385060 0.411895 K\n0.727306 0.659912 0.250000 Sn\n0.227306 0.840088 0.250000 Sn\n0.772694 0.159912 0.750000 Sn\n0.272694 0.340088 0.750000 Sn\n0.989088 0.724355 0.121036 O\n0.489088 0.775645 0.378964 O\n0.510912 0.224355 0.878964 O\n0.010912 0.275645 0.621036 O\n0.010912 0.275645 0.878964 O\n0.510912 0.224355 0.621036 O\n0.489088 0.775645 0.121036 O\n0.989088 0.724355 0.378964 O\n0.347403 0.607511 0.750000 O\n0.652597 0.392489 0.250000 O\n0.152597 0.107511 0.250000 O\n0.847403 0.892489 0.750000 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"K",
"Sn",
"O"
],
"chemical_system": "K-O-Sn",
"density": 3.700458809074017,
"density_atomic": 0.0545959503428111,
"volume": 439.5930439767533,
"volume_molar": 11.030379949770328,
"formula_full": "K8 Sn4 O12",
"formula_reduced": "K2SnO3",
"formula_anonymous": "AB2C3",
"energy": -131.35600287,
"energy_per_atom": -5.47316678625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -123.11200287,
"band_gap": 2.1547,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0002414,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:43.078000Z",
"spacegroup": 62
},
{
"id": "mp-865151",
"created_at": "2022-09-04T14:44:55.200617Z",
"structure_string": "Yb1 Nd1 Rh2\n1.0\n0.000000 3.444573 3.444573\n3.444573 0.000000 3.444573\n3.444573 3.444573 0.000000\nYb Nd Rh\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.500000 Nd\n0.250000 0.250000 0.250000 Rh\n0.750000 0.750000 0.750000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Nd",
"Rh"
],
"chemical_system": "Nd-Rh-Yb",
"density": 10.626538766780115,
"density_atomic": 0.04893547592283728,
"volume": 81.74029013853473,
"volume_molar": 12.306288324437402,
"formula_full": "Yb1 Nd1 Rh2",
"formula_reduced": "YbNdRh2",
"formula_anonymous": "ABC2",
"energy": -23.62631357,
"energy_per_atom": -5.9065783925,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -23.62631357,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0083508,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:43.997000Z",
"spacegroup": 225
},
{
"id": "mp-556597",
"created_at": "2022-09-04T14:44:55.201691Z",
"structure_string": "In6 S8\n1.0\n0.000000 5.581436 5.581436\n5.581436 0.000000 5.581436\n5.581436 5.581436 0.000000\nIn S\n6 8\ndirect\n0.750000 0.750000 0.750000 In\n0.625000 0.125000 0.125000 In\n0.125000 0.125000 0.625000 In\n0.125000 0.125000 0.125000 In\n0.500000 0.500000 0.500000 In\n0.125000 0.625000 0.125000 In\n0.903751 0.365416 0.365416 S\n0.365416 0.903751 0.365416 S\n0.365416 0.365416 0.365416 S\n0.884584 0.884584 0.346249 S\n0.365416 0.365416 0.903751 S\n0.884584 0.346249 0.884584 S\n0.884584 0.884584 0.884584 S\n0.346249 0.884584 0.884584 S\n",
"nsites": 14,
"nelements": 2,
"elements": [
"In",
"S"
],
"chemical_system": "In-S",
"density": 4.514500593163077,
"density_atomic": 0.04025874128917008,
"volume": 347.75056426729645,
"volume_molar": 14.95859176705061,
"formula_full": "In6 S8",
"formula_reduced": "In3S4",
"formula_anonymous": "A3B4",
"energy": -60.33148832,
"energy_per_atom": -4.309392022857143,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -56.30748832,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002655,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:46.260000Z",
"spacegroup": 227
},
{
"id": "mp-760",
"created_at": "2022-09-04T14:44:55.204766Z",
"structure_string": "Fe2 Se4\n1.0\n3.600591 0.000000 0.000000\n0.000000 4.808820 0.000000\n0.000000 0.000000 5.783169\nFe Se\n2 4\ndirect\n0.000000 0.000000 0.000000 Fe\n0.500000 0.500000 0.500000 Fe\n0.000000 0.218251 0.367196 Se\n0.000000 0.781749 0.632804 Se\n0.500000 0.718251 0.132804 Se\n0.500000 0.281749 0.867196 Se\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Fe",
"Se"
],
"chemical_system": "Fe-Se",
"density": 7.089857326606138,
"density_atomic": 0.059920172344248575,
"volume": 100.13322334136959,
"volume_molar": 10.050272761904084,
"formula_full": "Fe2 Se4",
"formula_reduced": "FeSe2",
"formula_anonymous": "AB2",
"energy": -34.94199009,
"energy_per_atom": -5.823665015,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -33.05399009,
"band_gap": 0.3741000000000003,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 1.16e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:40.677000Z",
"spacegroup": 58
},
{
"id": "mp-1094215",
"created_at": "2022-09-04T14:44:55.224339Z",
"structure_string": "Mg3 Sn3\n1.0\n1.705358 5.789478 0.000000\n-1.705358 5.789478 0.000000\n0.000000 2.736616 7.499927\nMg Sn\n3 3\ndirect\n0.988029 0.988029 0.003599 Mg\n0.611414 0.611414 0.275146 Mg\n0.676907 0.676907 0.664744 Mg\n0.332081 0.332081 0.327228 Sn\n0.959246 0.959246 0.615963 Sn\n0.265655 0.265655 0.946652 Sn\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Sn"
],
"chemical_system": "Mg-Sn",
"density": 4.810718445480955,
"density_atomic": 0.04051438470849407,
"volume": 148.09554786949698,
"volume_molar": 14.864203919990482,
"formula_full": "Mg3 Sn3",
"formula_reduced": "MgSn",
"formula_anonymous": "AB",
"energy": -17.26253235,
"energy_per_atom": -2.877088725,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -17.26253235,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 3.06e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:43.432000Z",
"spacegroup": 8
},
{
"id": "mp-1184759",
"created_at": "2022-09-04T14:44:55.364821Z",
"structure_string": "Ir1 Pt3\n1.0\n3.951253 0.000000 0.000000\n0.000000 3.951253 0.000000\n0.000000 0.000000 3.951253\nIr Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Ir\n0.000000 0.500000 0.500000 Pt\n0.500000 0.000000 0.500000 Pt\n0.500000 0.500000 0.000000 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ir",
"Pt"
],
"chemical_system": "Ir-Pt",
"density": 20.927996939625864,
"density_atomic": 0.06484186170192248,
"volume": 61.68854340407387,
"volume_molar": 9.287427291467559,
"formula_full": "Ir1 Pt3",
"formula_reduced": "IrPt3",
"formula_anonymous": "AB3",
"energy": -26.72528498,
"energy_per_atom": -6.681321245,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -26.72528498,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.2916785,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:46.397000Z",
"spacegroup": 221
},
{
"id": "mp-28044",
"created_at": "2022-09-04T14:44:55.939622Z",
"structure_string": "Tm2 Cl6\n1.0\n6.314098 -3.328944 0.000000\n6.314098 3.328944 0.000000\n4.558999 0.000000 5.492288\nTm Cl\n2 6\ndirect\n0.500000 0.500000 0.500000 Tm\n0.000000 0.000000 0.000000 Tm\n0.750000 0.392877 0.107123 Cl\n0.107123 0.750000 0.392877 Cl\n0.607123 0.892877 0.250000 Cl\n0.892877 0.250000 0.607123 Cl\n0.250000 0.607123 0.892877 Cl\n0.392877 0.107123 0.750000 Cl\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Tm",
"Cl"
],
"chemical_system": "Cl-Tm",
"density": 3.959802151608826,
"density_atomic": 0.03464885450241224,
"volume": 230.88786382369565,
"volume_molar": 17.380490196525088,
"formula_full": "Tm2 Cl6",
"formula_reduced": "TmCl3",
"formula_anonymous": "AB3",
"energy": -41.6896179,
"energy_per_atom": -5.2112022375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -38.0056179,
"band_gap": 4.918,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0004018,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:44.466000Z",
"spacegroup": 167
},
{
"id": "mp-9223",
"created_at": "2022-09-04T14:44:55.207919Z",
"structure_string": "Sc3 Ge3 Ru3\n1.0\n3.500811 -6.063583 0.000000\n3.500811 6.063583 0.000000\n0.000000 0.000000 3.484092\nSc Ge Ru\n3 3 3\ndirect\n0.401072 0.401072 0.000000 Sc\n0.598928 0.000000 0.000000 Sc\n0.000000 0.598928 0.000000 Sc\n0.666667 0.333333 0.500000 Ge\n0.000000 0.000000 0.000000 Ge\n0.333333 0.666667 0.500000 Ge\n0.000000 0.253263 0.500000 Ru\n0.746737 0.746737 0.500000 Ru\n0.253263 0.000000 0.500000 Ru\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Sc",
"Ge",
"Ru"
],
"chemical_system": "Ge-Ru-Sc",
"density": 7.364340091073165,
"density_atomic": 0.06084500173252416,
"volume": 147.91683365486912,
"volume_molar": 9.897511033812524,
"formula_full": "Sc3 Ge3 Ru3",
"formula_reduced": "ScGeRu",
"formula_anonymous": "ABC",
"energy": -67.83605402,
"energy_per_atom": -7.537339335555556,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -67.83605402,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002229,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:46.135000Z",
"spacegroup": 189
},
{
"id": "mp-23044",
"created_at": "2022-09-04T14:44:55.214731Z",
"structure_string": "V2 Bi2 O8\n1.0\n-2.594020 2.594020 5.867083\n2.594020 -2.594020 5.867083\n2.594020 2.594020 -5.867083\nV Bi O\n2 2 8\ndirect\n0.500000 0.500000 0.000000 V\n0.250000 0.750000 0.500000 V\n0.000000 0.000000 0.000000 Bi\n0.750000 0.250000 0.500000 Bi\n0.170125 0.562675 0.890939 O\n0.312675 0.921736 0.892550 O\n0.029186 0.420125 0.107450 O\n0.671736 0.279186 0.109061 O\n0.078264 0.970814 0.390939 O\n0.720814 0.829875 0.392550 O\n0.579875 0.687325 0.609061 O\n0.437325 0.328264 0.607450 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"V",
"Bi",
"O"
],
"chemical_system": "Bi-O-V",
"density": 6.81219894492985,
"density_atomic": 0.07598928921352635,
"volume": 157.91699230506765,
"volume_molar": 7.924986300474619,
"formula_full": "V2 Bi2 O8",
"formula_reduced": "VBiO4",
"formula_anonymous": "ABC4",
"energy": -91.15090643,
"energy_per_atom": -7.595908869166667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -82.25490643,
"band_gap": 2.2615,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0006597,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:44.753000Z",
"spacegroup": 88
}
]
}