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=-nsites&page=12132",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-nsites&page=12130",
"results": [
{
"id": "mp-7142",
"created_at": "2022-09-04T14:44:15.328026Z",
"structure_string": "Os1 C1\n1.0\n1.473934 -2.552929 0.000000\n1.473934 2.552929 0.000000\n0.000000 0.000000 2.730268\nOs C\n1 1\ndirect\n0.000000 0.000000 0.000000 Os\n0.666667 0.333333 0.500000 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Os",
"C"
],
"chemical_system": "C-Os",
"density": 16.344273040301225,
"density_atomic": 0.09733699784720046,
"volume": 20.547171622650602,
"volume_molar": 6.186897986573976,
"formula_full": "Os1 C1",
"formula_reduced": "OsC",
"formula_anonymous": "AB",
"energy": -18.6238624,
"energy_per_atom": -9.3119312,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -18.6238624,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0007381,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:32.359000Z",
"spacegroup": 187
},
{
"id": "mp-1060967",
"created_at": "2022-09-04T14:44:11.656243Z",
"structure_string": "Ag1 Br1\n1.0\n3.604067 0.000000 0.000000\n0.000000 3.604067 0.000000\n0.000000 0.000000 3.604067\nAg Br\n1 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.500000 Br\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ag",
"Br"
],
"chemical_system": "Ag-Br",
"density": 6.6604231893666155,
"density_atomic": 0.042721985449811054,
"volume": 46.814303664551375,
"volume_molar": 14.09611631246561,
"formula_full": "Ag1 Br1",
"formula_reduced": "AgBr",
"formula_anonymous": "AB",
"energy": -5.2948371,
"energy_per_atom": -2.64741855,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -4.7608371,
"band_gap": 0.1213999999999999,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0004218,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:30.389000Z",
"spacegroup": 221
},
{
"id": "mp-22704",
"created_at": "2022-09-04T14:44:09.935465Z",
"structure_string": "Y1 In1\n1.0\n3.774342 0.000000 0.000000\n0.000000 3.774342 0.000000\n0.000000 0.000000 3.774342\nY In\n1 1\ndirect\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 In\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Y",
"In"
],
"chemical_system": "In-Y",
"density": 6.291688648590425,
"density_atomic": 0.03719685709159678,
"volume": 53.76798354428241,
"volume_molar": 16.189918264251617,
"formula_full": "Y1 In1",
"formula_reduced": "YIn",
"formula_anonymous": "AB",
"energy": -10.18673719,
"energy_per_atom": -5.093368595,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -10.18673719,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 8.5e-06,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:33.487000Z",
"spacegroup": 221
},
{
"id": "mp-1001789",
"created_at": "2022-09-04T14:44:05.783287Z",
"structure_string": "Ir1 C1\n1.0\n0.000000 2.317418 2.317418\n2.317418 0.000000 2.317418\n2.317418 2.317418 0.000000\nIr C\n1 1\ndirect\n0.000000 0.000000 0.000000 Ir\n0.250000 0.250000 0.250000 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ir",
"C"
],
"chemical_system": "C-Ir",
"density": 13.624501479679607,
"density_atomic": 0.08035018337259162,
"volume": 24.891044625571116,
"volume_molar": 7.494868719931537,
"formula_full": "Ir1 C1",
"formula_reduced": "IrC",
"formula_anonymous": "AB",
"energy": -17.00326099,
"energy_per_atom": -8.501630495,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -17.00326099,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0017278,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:34.225000Z",
"spacegroup": 216
},
{
"id": "mp-2384",
"created_at": "2022-09-04T14:44:17.197307Z",
"structure_string": "La1 P1\n1.0\n0.000000 3.025454 3.025454\n3.025454 0.000000 3.025454\n3.025454 3.025454 0.000000\nLa P\n1 1\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.500000 P\n",
"nsites": 2,
"nelements": 2,
"elements": [
"La",
"P"
],
"chemical_system": "La-P",
"density": 5.093164792301468,
"density_atomic": 0.036110070598523905,
"volume": 55.38621129369255,
"volume_molar": 16.67717802868591,
"formula_full": "La1 P1",
"formula_reduced": "LaP",
"formula_anonymous": "AB",
"energy": -13.48584123,
"energy_per_atom": -6.742920615,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -13.48584123,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 5.9e-06,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:25.579000Z",
"spacegroup": 225
},
{
"id": "mp-972",
"created_at": "2022-09-04T14:44:13.970742Z",
"structure_string": "Mn1 Se1\n1.0\n0.000000 2.705372 2.705372\n2.705372 0.000000 2.705372\n2.705372 2.705372 0.000000\nMn Se\n1 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 Se\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mn",
"Se"
],
"chemical_system": "Mn-Se",
"density": 5.61451653626959,
"density_atomic": 0.05050321517755933,
"volume": 39.60143909587528,
"volume_molar": 11.924272026696404,
"formula_full": "Mn1 Se1",
"formula_reduced": "MnSe",
"formula_anonymous": "AB",
"energy": -13.81191667,
"energy_per_atom": -6.905958335,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -13.33991667,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 4.7695077,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:30.219000Z",
"spacegroup": 225
},
{
"id": "mp-1176",
"created_at": "2022-09-04T14:44:05.069253Z",
"structure_string": "Tb1 Te1\n1.0\n0.000000 3.092048 3.092048\n3.092048 0.000000 3.092048\n3.092048 3.092048 0.000000\nTb Te\n1 1\ndirect\n0.000000 0.000000 0.000000 Tb\n0.500000 0.500000 0.500000 Te\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Tb",
"Te"
],
"chemical_system": "Tb-Te",
"density": 8.047175484030037,
"density_atomic": 0.033826831379490274,
"volume": 59.12466283237603,
"volume_molar": 17.802852098205438,
"formula_full": "Tb1 Te1",
"formula_reduced": "TbTe",
"formula_anonymous": "AB",
"energy": -10.81342338,
"energy_per_atom": -5.40671169,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -10.39142338,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0007246,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:37.834000Z",
"spacegroup": 225
},
{
"id": "mp-1183669",
"created_at": "2022-09-04T14:44:08.295052Z",
"structure_string": "Cd1 In1\n1.0\n1.658750 -2.873040 0.000000\n1.658750 2.873040 0.000000\n0.000000 0.000000 5.460557\nCd In\n1 1\ndirect\n0.000000 0.000000 0.500000 Cd\n0.666667 0.333333 0.000000 In\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Cd",
"In"
],
"chemical_system": "Cd-In",
"density": 7.249754593023246,
"density_atomic": 0.03842735095408609,
"volume": 52.046262631781396,
"volume_molar": 15.67149598002578,
"formula_full": "Cd1 In1",
"formula_reduced": "CdIn",
"formula_anonymous": "AB",
"energy": -3.59595636,
"energy_per_atom": -1.79797818,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -3.59595636,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0013255,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:32.315000Z",
"spacegroup": 187
},
{
"id": "mp-10628",
"created_at": "2022-09-04T14:44:13.918592Z",
"structure_string": "Ta1 S1\n1.0\n1.640445 -2.841334 0.000000\n1.640445 2.841334 0.000000\n0.000000 0.000000 3.332707\nTa S\n1 1\ndirect\n0.666667 0.333333 0.000000 Ta\n0.000000 0.000000 0.500000 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ta",
"S"
],
"chemical_system": "S-Ta",
"density": 11.385284042141908,
"density_atomic": 0.06437524634008472,
"volume": 31.067842279535547,
"volume_molar": 9.354745965842117,
"formula_full": "Ta1 S1",
"formula_reduced": "TaS",
"formula_anonymous": "AB",
"energy": -17.84092865,
"energy_per_atom": -8.920464325,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -17.33792865,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001694,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:34.331000Z",
"spacegroup": 187
},
{
"id": "mp-1031",
"created_at": "2022-09-04T14:44:15.927582Z",
"structure_string": "Gd1 Cd1\n1.0\n3.772169 0.000000 0.000000\n0.000000 3.772169 0.000000\n0.000000 0.000000 3.772169\nGd Cd\n1 1\ndirect\n0.500000 0.500000 0.500000 Gd\n0.000000 0.000000 0.000000 Cd\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Gd",
"Cd"
],
"chemical_system": "Cd-Gd",
"density": 8.342453855604024,
"density_atomic": 0.03726117712210058,
"volume": 53.6751695590891,
"volume_molar": 16.161971320085083,
"formula_full": "Gd1 Cd1",
"formula_reduced": "GdCd",
"formula_anonymous": "AB",
"energy": -15.68919825,
"energy_per_atom": -7.844599125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.68919825,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.5297838,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:32.663000Z",
"spacegroup": 221
},
{
"id": "mp-915",
"created_at": "2022-09-04T14:44:10.382946Z",
"structure_string": "Y1 Cd1\n1.0\n3.757206 0.000000 0.000000\n0.000000 3.757206 0.000000\n0.000000 0.000000 3.757206\nY Cd\n1 1\ndirect\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.500000 Cd\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Y",
"Cd"
],
"chemical_system": "Cd-Y",
"density": 6.302809809078987,
"density_atomic": 0.03770812812429691,
"volume": 53.0389626715869,
"volume_molar": 15.9704049486341,
"formula_full": "Y1 Cd1",
"formula_reduced": "YCd",
"formula_anonymous": "AB",
"energy": -8.10084168,
"energy_per_atom": -4.05042084,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.10084168,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0061284,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:31.712000Z",
"spacegroup": 221
},
{
"id": "mp-1184687",
"created_at": "2022-09-04T14:44:08.314888Z",
"structure_string": "Hg2\n1.0\n0.000000 2.970073 6.035906\n1.839716 0.000000 6.035906\n1.839716 2.970073 0.000000\nHg\n2\ndirect\n0.365981 0.365981 0.634019 Hg\n0.634019 0.634019 0.365981 Hg\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Hg"
],
"chemical_system": "Hg",
"density": 10.099456407188216,
"density_atomic": 0.03032072790497509,
"volume": 65.96147712112926,
"volume_molar": 19.861464998048,
"formula_full": "Hg2",
"formula_reduced": "Hg",
"formula_anonymous": "A",
"energy": -0.56896506,
"energy_per_atom": -0.28448253,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -0.56896506,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.011643,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:29.079000Z",
"spacegroup": 69
}
]
}