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=volume&page=15",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=volume&page=13",
"results": [
{
"id": "mp-1017519",
"created_at": "2022-09-04T14:39:15.027933Z",
"structure_string": "Ir1 C1\n1.0\n2.730070 0.000000 0.000000\n0.000000 2.730070 0.000000\n0.000000 0.000000 2.730070\nIr C\n1 1\ndirect\n0.000000 0.000000 0.000000 Ir\n0.500000 0.500000 0.500000 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ir",
"C"
],
"chemical_system": "C-Ir",
"density": 16.666422834774416,
"density_atomic": 0.09828984443478982,
"volume": 20.347982149131344,
"volume_molar": 6.126920634201814,
"formula_full": "Ir1 C1",
"formula_reduced": "IrC",
"formula_anonymous": "AB",
"energy": -14.73315976,
"energy_per_atom": -7.36657988,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -14.73315976,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0018188,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:39.776000Z",
"spacegroup": 221
},
{
"id": "mp-1009769",
"created_at": "2022-09-04T14:47:23.954829Z",
"structure_string": "Ru1 N1\n1.0\n0.000000 2.167445 2.167445\n2.167445 0.000000 2.167445\n2.167445 2.167445 0.000000\nRu N\n1 1\ndirect\n0.000000 0.000000 0.000000 Ru\n0.500000 0.500000 0.500000 N\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ru",
"N"
],
"chemical_system": "N-Ru",
"density": 9.38344350533209,
"density_atomic": 0.09821000710334199,
"volume": 20.36452352452729,
"volume_molar": 6.1319013587517315,
"formula_full": "Ru1 N1",
"formula_reduced": "RuN",
"formula_anonymous": "AB",
"energy": -16.12323101,
"energy_per_atom": -8.061615505,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.76223101,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.0346265,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:08.229000Z",
"spacegroup": 225
},
{
"id": "mp-631",
"created_at": "2022-09-04T14:39:49.376825Z",
"structure_string": "Ti1 C1\n1.0\n0.000000 2.167825 2.167825\n2.167825 0.000000 2.167825\n2.167825 2.167825 0.000000\nTi C\n1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500000 0.500000 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ti",
"C"
],
"chemical_system": "C-Ti",
"density": 4.879907058924726,
"density_atomic": 0.09815837019363803,
"volume": 20.375236427159287,
"volume_molar": 6.135127089131636,
"formula_full": "Ti1 C1",
"formula_reduced": "TiC",
"formula_anonymous": "AB",
"energy": -18.74228076,
"energy_per_atom": -9.37114038,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -18.74228076,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 4.44e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:35.548000Z",
"spacegroup": 225
},
{
"id": "mp-1009735",
"created_at": "2022-09-04T14:43:59.307281Z",
"structure_string": "Re1 C1\n1.0\n1.443227 -2.499743 0.000000\n1.443227 2.499743 0.000000\n0.000000 0.000000 2.824472\nRe C\n1 1\ndirect\n0.000000 0.000000 0.000000 Re\n0.333333 0.666667 0.500000 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Re",
"C"
],
"chemical_system": "C-Re",
"density": 16.15080801019541,
"density_atomic": 0.09813698701856,
"volume": 20.379676009634913,
"volume_molar": 6.1364638786608285,
"formula_full": "Re1 C1",
"formula_reduced": "ReC",
"formula_anonymous": "AB",
"energy": -21.1859564,
"energy_per_atom": -10.5929782,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -21.1859564,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0044568,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:23.788000Z",
"spacegroup": 187
},
{
"id": "mp-2229",
"created_at": "2022-09-04T14:48:05.312018Z",
"structure_string": "Zn1 O1\n1.0\n0.000000 2.169442 2.169442\n2.169442 0.000000 2.169442\n2.169442 2.169442 0.000000\nZn O\n1 1\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 O\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Zn",
"O"
],
"chemical_system": "O-Zn",
"density": 6.619789652587246,
"density_atomic": 0.09793904585582935,
"volume": 20.420864656411798,
"volume_molar": 6.148866070091043,
"formula_full": "Zn1 O1",
"formula_reduced": "ZnO",
"formula_anonymous": "AB",
"energy": -9.49491029,
"energy_per_atom": -4.747455145,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.80791029,
"band_gap": 0.7218999999999998,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0065712,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:29.901000Z",
"spacegroup": 225
},
{
"id": "mp-1002183",
"created_at": "2022-09-04T14:39:40.849629Z",
"structure_string": "Tc1 B1\n1.0\n2.733406 0.000000 0.000000\n0.000000 2.733406 0.000000\n0.000000 0.000000 2.733406\nTc B\n1 1\ndirect\n0.000000 0.000000 0.000000 Tc\n0.500000 0.500000 0.500000 B\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Tc",
"B"
],
"chemical_system": "B-Tc",
"density": 8.847273823092936,
"density_atomic": 0.09793040836559035,
"volume": 20.42266578255929,
"volume_molar": 6.149408401850379,
"formula_full": "Tc1 B1",
"formula_reduced": "TcB",
"formula_anonymous": "AB",
"energy": -16.76861589,
"energy_per_atom": -8.384307945,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -16.76861589,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0019581,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:31.090000Z",
"spacegroup": 221
},
{
"id": "mp-1008630",
"created_at": "2022-09-04T14:40:25.390224Z",
"structure_string": "W1 C1\n1.0\n2.733434 0.000000 0.000000\n0.000000 2.733434 0.000000\n0.000000 0.000000 2.733434\nW C\n1 1\ndirect\n0.000000 0.000000 0.000000 W\n0.500000 0.500000 0.500000 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"W",
"C"
],
"chemical_system": "C-W",
"density": 15.923863613474754,
"density_atomic": 0.09792739893860651,
"volume": 20.42329339569059,
"volume_molar": 6.149597380581355,
"formula_full": "W1 C1",
"formula_reduced": "WC",
"formula_anonymous": "AB",
"energy": -20.63219277,
"energy_per_atom": -10.316096385,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -20.63219277,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.000564,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:52.786000Z",
"spacegroup": 221
},
{
"id": "mp-1009837",
"created_at": "2022-09-04T14:43:50.463752Z",
"structure_string": "Tc1 C1\n1.0\n0.000000 2.170000 2.170000\n2.170000 0.000000 2.170000\n2.170000 2.170000 0.000000\nTc C\n1 1\ndirect\n0.000000 0.000000 0.000000 Tc\n0.500000 0.500000 0.500000 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Tc",
"C"
],
"chemical_system": "C-Tc",
"density": 8.938709603728746,
"density_atomic": 0.09786351230384115,
"volume": 20.436626,
"volume_molar": 6.153611921573788,
"formula_full": "Tc1 C1",
"formula_reduced": "TcC",
"formula_anonymous": "AB",
"energy": -18.28806143,
"energy_per_atom": -9.144030715,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -18.28806143,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.4283744,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:20.646000Z",
"spacegroup": 225
},
{
"id": "mp-1009646",
"created_at": "2022-09-04T14:40:25.731755Z",
"structure_string": "Re1 N1\n1.0\n1.396993 -2.419663 0.000000\n1.396993 2.419663 0.000000\n0.000000 0.000000 3.030202\nRe N\n1 1\ndirect\n0.000000 0.000000 0.000000 Re\n0.666667 0.333333 0.500000 N\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Re",
"N"
],
"chemical_system": "N-Re",
"density": 16.22901640782547,
"density_atomic": 0.09762910453984829,
"volume": 20.485694398473974,
"volume_molar": 6.168386761697691,
"formula_full": "Re1 N1",
"formula_reduced": "ReN",
"formula_anonymous": "AB",
"energy": -19.81705192,
"energy_per_atom": -9.90852596,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -19.45605192,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0003249,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:52.860000Z",
"spacegroup": 187
},
{
"id": "mp-119",
"created_at": "2022-09-04T14:43:00.408254Z",
"structure_string": "Se1\n1.0\n-1.723875 1.723875 1.723875\n1.723875 -1.723875 1.723875\n1.723875 1.723875 -1.723875\nSe\n1\ndirect\n0.000000 0.000000 0.000000 Se\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Se"
],
"chemical_system": "Se",
"density": 6.398511154134527,
"density_atomic": 0.04880032274309051,
"volume": 20.49166775524219,
"volume_molar": 12.34037076292217,
"formula_full": "Se1",
"formula_reduced": "Se",
"formula_anonymous": "A",
"energy": -2.90028467,
"energy_per_atom": -2.90028467,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -2.90028467,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0026801,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:57.071000Z",
"spacegroup": 229
},
{
"id": "mp-1220318",
"created_at": "2022-09-04T14:42:55.231918Z",
"structure_string": "Nb1 H1\n1.0\n-1.606964 1.606964 -1.984301\n1.606964 -1.606964 -1.984301\n-1.606964 -1.606964 -1.984301\nNb H\n1 1\ndirect\n0.000000 0.000000 0.000000 Nb\n0.500000 0.500000 0.000000 H\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Nb",
"H"
],
"chemical_system": "H-Nb",
"density": 7.608535617205704,
"density_atomic": 0.09757760580094821,
"volume": 20.496506176631,
"volume_molar": 6.171642264194066,
"formula_full": "Nb1 H1",
"formula_reduced": "NbH",
"formula_anonymous": "AB",
"energy": -13.89652201,
"energy_per_atom": -6.948261005,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -13.71752201,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0008384,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:56.719000Z",
"spacegroup": 139
},
{
"id": "mp-10",
"created_at": "2022-09-04T14:47:27.019791Z",
"structure_string": "As1\n1.0\n2.737511 0.000000 0.000000\n0.000000 2.737511 0.000000\n0.000000 0.000000 2.737511\nAs\n1\ndirect\n0.500000 0.500000 0.500000 As\n",
"nsites": 1,
"nelements": 1,
"elements": [
"As"
],
"chemical_system": "As",
"density": 6.064409536915891,
"density_atomic": 0.048745258870892635,
"volume": 20.514815659274962,
"volume_molar": 12.354310756560603,
"formula_full": "As1",
"formula_reduced": "As",
"formula_anonymous": "A",
"energy": -4.5467212,
"energy_per_atom": -4.5467212,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -4.5467212,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.000195,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:10.306000Z",
"spacegroup": 221
}
]
}