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=12116",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-nsites&page=12114",
"results": [
{
"id": "mp-2143",
"created_at": "2022-09-04T14:39:27.183754Z",
"structure_string": "U1 Se1\n1.0\n0.000000 2.866212 2.866212\n2.866212 0.000000 2.866212\n2.866212 2.866212 0.000000\nU Se\n1 1\ndirect\n0.500000 0.500000 0.500000 U\n0.000000 0.000000 0.000000 Se\n",
"nsites": 2,
"nelements": 2,
"elements": [
"U",
"Se"
],
"chemical_system": "Se-U",
"density": 11.177334304142475,
"density_atomic": 0.04246929681191941,
"volume": 47.092844716908075,
"volume_molar": 14.179986983702142,
"formula_full": "U1 Se1",
"formula_reduced": "USe",
"formula_anonymous": "AB",
"energy": -17.23480996,
"energy_per_atom": -8.61740498,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -16.76280996,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.489186,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:36.465000Z",
"spacegroup": 225
},
{
"id": "mp-1002109",
"created_at": "2022-09-04T14:39:35.551841Z",
"structure_string": "V1 Co1\n1.0\n2.895429 0.000000 0.000000\n0.000000 2.895429 0.000000\n0.000000 0.000000 2.895429\nV Co\n1 1\ndirect\n0.000000 0.000000 0.000000 V\n0.500000 0.500000 0.500000 Co\n",
"nsites": 2,
"nelements": 2,
"elements": [
"V",
"Co"
],
"chemical_system": "Co-V",
"density": 7.516367747422577,
"density_atomic": 0.08239317450582298,
"volume": 24.273855352650042,
"volume_molar": 7.3090286860769,
"formula_full": "V1 Co1",
"formula_reduced": "VCo",
"formula_anonymous": "AB",
"energy": -16.36449008,
"energy_per_atom": -8.18224504,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -16.36449008,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.8991424,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:35.841000Z",
"spacegroup": 221
},
{
"id": "mp-1002181",
"created_at": "2022-09-04T14:39:30.851791Z",
"structure_string": "Tc1 N1\n1.0\n0.000000 2.295397 2.295397\n2.295397 0.000000 2.295397\n2.295397 2.295397 0.000000\nTc N\n1 1\ndirect\n0.000000 0.000000 0.000000 Tc\n0.250000 0.250000 0.250000 N\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Tc",
"N"
],
"chemical_system": "N-Tc",
"density": 7.689350803147866,
"density_atomic": 0.08268496956981677,
"volume": 24.188192973951068,
"volume_molar": 7.283235140958817,
"formula_full": "Tc1 N1",
"formula_reduced": "TcN",
"formula_anonymous": "AB",
"energy": -18.85328682,
"energy_per_atom": -9.42664341,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -18.49228682,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0077819,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:36.300000Z",
"spacegroup": 216
},
{
"id": "mp-348",
"created_at": "2022-09-04T14:39:36.181759Z",
"structure_string": "Tm1 Pd1\n1.0\n3.465422 0.000000 0.000000\n0.000000 3.465422 0.000000\n0.000000 0.000000 3.465422\nTm Pd\n1 1\ndirect\n0.500000 0.500000 0.500000 Tm\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Tm",
"Pd"
],
"chemical_system": "Pd-Tm",
"density": 10.98683074028717,
"density_atomic": 0.048057548309989005,
"volume": 41.61677135710833,
"volume_molar": 12.531102754462129,
"formula_full": "Tm1 Pd1",
"formula_reduced": "TmPd",
"formula_anonymous": "AB",
"energy": -11.5546322,
"energy_per_atom": -5.7773161,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -11.5546322,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0024943,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:38.444000Z",
"spacegroup": 221
},
{
"id": "mp-1395",
"created_at": "2022-09-04T14:40:07.474919Z",
"structure_string": "V1 Ru1\n1.0\n3.014694 0.000000 0.000000\n0.000000 3.014694 0.000000\n0.000000 0.000000 3.014694\nV Ru\n1 1\ndirect\n0.500000 0.500000 0.500000 V\n0.000000 0.000000 0.000000 Ru\n",
"nsites": 2,
"nelements": 2,
"elements": [
"V",
"Ru"
],
"chemical_system": "Ru-V",
"density": 9.21288886283982,
"density_atomic": 0.07299620562579923,
"volume": 27.39868439535897,
"volume_molar": 8.24993670338336,
"formula_full": "V1 Ru1",
"formula_reduced": "VRu",
"formula_anonymous": "AB",
"energy": -18.82570789,
"energy_per_atom": -9.412853945,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -18.82570789,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.647887,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:46.112000Z",
"spacegroup": 221
},
{
"id": "mp-1094669",
"created_at": "2022-09-04T14:40:08.532708Z",
"structure_string": "Mg1 Sn1\n1.0\n3.661191 0.000000 0.000000\n0.000000 3.661191 0.000000\n0.000000 0.000000 3.661191\nMg Sn\n1 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Sn\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mg",
"Sn"
],
"chemical_system": "Mg-Sn",
"density": 4.839088107742555,
"density_atomic": 0.040753305240622935,
"volume": 49.0757740554108,
"volume_molar": 14.777060963381992,
"formula_full": "Mg1 Sn1",
"formula_reduced": "MgSn",
"formula_anonymous": "AB",
"energy": -5.77871328,
"energy_per_atom": -2.88935664,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -5.77871328,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0035447,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:47.110000Z",
"spacegroup": 221
},
{
"id": "mp-1060884",
"created_at": "2022-09-04T14:40:06.911766Z",
"structure_string": "U1 Cd1\n1.0\n6.382642 -1.465434 0.000000\n6.382642 1.465434 0.000000\n6.046182 0.000000 2.515808\nU Cd\n1 1\ndirect\n0.688121 0.688121 0.688121 U\n0.866879 0.866879 0.866879 Cd\n",
"nsites": 2,
"nelements": 2,
"elements": [
"U",
"Cd"
],
"chemical_system": "Cd-U",
"density": 12.364837662712269,
"density_atomic": 0.0424967538115938,
"volume": 47.06241819944299,
"volume_molar": 14.170825345151572,
"formula_full": "U1 Cd1",
"formula_reduced": "UCd",
"formula_anonymous": "AB",
"energy": -11.39373626,
"energy_per_atom": -5.69686813,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -11.39373626,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0120559,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:55.684000Z",
"spacegroup": 160
},
{
"id": "mp-2050",
"created_at": "2022-09-04T14:40:07.527193Z",
"structure_string": "Ho1 Sb1\n1.0\n0.000000 3.090637 3.090637\n3.090637 0.000000 3.090637\n3.090637 3.090637 0.000000\nHo Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 Ho\n0.500000 0.500000 0.500000 Sb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ho",
"Sb"
],
"chemical_system": "Ho-Sb",
"density": 8.062841688700322,
"density_atomic": 0.03387318245815151,
"volume": 59.04375836167422,
"volume_molar": 17.778491192671456,
"formula_full": "Ho1 Sb1",
"formula_reduced": "HoSb",
"formula_anonymous": "AB",
"energy": -11.11526614,
"energy_per_atom": -5.55763307,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -10.92326614,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0003768,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:47.686000Z",
"spacegroup": 225
},
{
"id": "mp-2691",
"created_at": "2022-09-04T14:40:08.006036Z",
"structure_string": "Cd1 Se1\n1.0\n0.000000 3.106417 3.106417\n3.106417 0.000000 3.106417\n3.106417 3.106417 0.000000\nCd Se\n1 1\ndirect\n0.000000 0.000000 0.000000 Cd\n0.750000 0.750000 0.750000 Se\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Cd",
"Se"
],
"chemical_system": "Cd-Se",
"density": 5.300489339037397,
"density_atomic": 0.03335959252717866,
"volume": 59.952770657212426,
"volume_molar": 18.05220119248655,
"formula_full": "Cd1 Se1",
"formula_reduced": "CdSe",
"formula_anonymous": "AB",
"energy": -6.130016,
"energy_per_atom": -3.065008,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -5.658016,
"band_gap": 0.5096,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:46.924000Z",
"spacegroup": 216
},
{
"id": "mp-1215923",
"created_at": "2022-09-04T14:40:25.309208Z",
"structure_string": "Y1 Th1\n1.0\n1.764375 -3.055987 0.000000\n1.764375 3.055987 0.000000\n0.000000 0.000000 5.949792\nY Th\n1 1\ndirect\n0.000000 0.000000 0.000000 Y\n0.333333 0.666667 0.500000 Th\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Y",
"Th"
],
"chemical_system": "Th-Y",
"density": 8.306232048805978,
"density_atomic": 0.031171364865854027,
"volume": 64.16145101784925,
"volume_molar": 19.31946446976667,
"formula_full": "Y1 Th1",
"formula_reduced": "YTh",
"formula_anonymous": "AB",
"energy": -13.7419007,
"energy_per_atom": -6.87095035,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -13.7419007,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0047955,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:54.109000Z",
"spacegroup": 187
},
{
"id": "mp-20812",
"created_at": "2022-09-04T14:40:03.328203Z",
"structure_string": "In1 N1\n1.0\n0.000000 2.354721 2.354721\n2.354721 0.000000 2.354721\n2.354721 2.354721 0.000000\nIn N\n1 1\ndirect\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.500000 N\n",
"nsites": 2,
"nelements": 2,
"elements": [
"In",
"N"
],
"chemical_system": "In-N",
"density": 8.192187253600032,
"density_atomic": 0.07659168589642538,
"volume": 26.112494803999898,
"volume_molar": 7.8626559652228005,
"formula_full": "In1 N1",
"formula_reduced": "InN",
"formula_anonymous": "AB",
"energy": -10.82418329,
"energy_per_atom": -5.412091645,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -10.46318329,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001913,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:47.800000Z",
"spacegroup": 225
},
{
"id": "mp-1221545",
"created_at": "2022-09-04T14:42:02.942550Z",
"structure_string": "Mn1 Pt1\n1.0\n4.378194 -1.344623 0.000000\n4.378194 1.344623 0.000000\n3.965236 0.000000 2.292051\nMn Pt\n1 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 Pt\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mn",
"Pt"
],
"chemical_system": "Mn-Pt",
"density": 15.384294711441385,
"density_atomic": 0.07411057555156003,
"volume": 26.986701764427192,
"volume_molar": 8.125885833676046,
"formula_full": "Mn1 Pt1",
"formula_reduced": "MnPt",
"formula_anonymous": "AB",
"energy": -15.24847074,
"energy_per_atom": -7.62423537,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.24847074,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 3.6529062,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:31.751000Z",
"spacegroup": 166
}
]
}