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=11502",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-nsites&page=11500",
"results": [
{
"id": "mp-866011",
"created_at": "2022-09-04T14:44:16.017119Z",
"structure_string": "Dy1 Th1 Tc2\n1.0\n0.000000 3.477907 3.477907\n3.477907 0.000000 3.477907\n3.477907 3.477907 0.000000\nDy Th Tc\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Dy\n0.000000 0.000000 0.000000 Th\n0.250000 0.250000 0.250000 Tc\n0.750000 0.750000 0.750000 Tc\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Dy",
"Th",
"Tc"
],
"chemical_system": "Dy-Tc-Th",
"density": 11.655022083050573,
"density_atomic": 0.04754185264150087,
"volume": 84.13639304641373,
"volume_molar": 12.667030049104717,
"formula_full": "Dy1 Th1 Tc2",
"formula_reduced": "DyThTc2",
"formula_anonymous": "ABC2",
"energy": -32.84827635,
"energy_per_atom": -8.2120690875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.84827635,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0008167,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:30.447000Z",
"spacegroup": 225
},
{
"id": "mp-1183172",
"created_at": "2022-09-04T14:44:19.074083Z",
"structure_string": "Ac2 O2\n1.0\n2.190196 -3.793529 0.000000\n2.190196 3.793529 0.000000\n0.000000 0.000000 5.629032\nAc O\n2 2\ndirect\n0.000000 0.000000 0.938904 Ac\n0.333332 0.666666 0.438904 Ac\n0.000000 0.000000 0.436094 O\n0.333332 0.666666 0.936096 O\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ac",
"O"
],
"chemical_system": "Ac-O",
"density": 8.627683228517736,
"density_atomic": 0.04276316966443564,
"volume": 93.53843579388911,
"volume_molar": 14.082540670525564,
"formula_full": "Ac2 O2",
"formula_reduced": "AcO",
"formula_anonymous": "AB",
"energy": -29.84011132,
"energy_per_atom": -7.46002783,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -28.46611132,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 1.3599422,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:28.305000Z",
"spacegroup": 194
},
{
"id": "mp-862745",
"created_at": "2022-09-04T14:44:12.032221Z",
"structure_string": "Sr2 Li1 Pt1\n1.0\n0.000000 3.811296 3.811296\n3.811296 0.000000 3.811296\n3.811296 3.811296 0.000000\nSr Li Pt\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750000 Sr\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Li",
"Pt"
],
"chemical_system": "Li-Pt-Sr",
"density": 5.657799863569536,
"density_atomic": 0.0361253412663238,
"volume": 110.72559759397532,
"volume_molar": 16.67012836115092,
"formula_full": "Sr2 Li1 Pt1",
"formula_reduced": "Sr2LiPt",
"formula_anonymous": "ABC2",
"energy": -12.92632743,
"energy_per_atom": -3.2315818575,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.92632743,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0004849,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:26.762000Z",
"spacegroup": 225
},
{
"id": "mp-1184817",
"created_at": "2022-09-04T14:44:18.506320Z",
"structure_string": "Ho1 Zn1 Pd2\n1.0\n0.000000 3.301614 3.301614\n3.301614 0.000000 3.301614\n3.301614 3.301614 0.000000\nHo Zn Pd\n1 1 2\ndirect\n0.249999 0.249999 0.249999 Ho\n0.750000 0.750000 0.750000 Zn\n0.000000 0.000000 0.000000 Pd\n0.500000 0.500000 0.500000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ho",
"Zn",
"Pd"
],
"chemical_system": "Ho-Pd-Zn",
"density": 10.223973055917343,
"density_atomic": 0.05557136997318281,
"volume": 71.97951034732972,
"volume_molar": 10.836768578687401,
"formula_full": "Ho1 Zn1 Pd2",
"formula_reduced": "HoZnPd2",
"formula_anonymous": "ABC2",
"energy": -19.2140213,
"energy_per_atom": -4.803505325,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -19.2140213,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0006669,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:32.086000Z",
"spacegroup": 225
},
{
"id": "mp-1187265",
"created_at": "2022-09-04T14:44:15.934817Z",
"structure_string": "Tb2 Ir1 Au1\n1.0\n0.000000 3.530675 3.530675\n3.530675 0.000000 3.530675\n3.530675 3.530675 0.000000\nTb Ir Au\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Tb\n0.750000 0.750000 0.750000 Tb\n0.000000 0.000000 0.000000 Ir\n0.500000 0.500000 0.500000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tb",
"Ir",
"Au"
],
"chemical_system": "Au-Ir-Tb",
"density": 13.337865648829133,
"density_atomic": 0.04544193000239174,
"volume": 88.0244302957526,
"volume_molar": 13.252387738995763,
"formula_full": "Tb2 Ir1 Au1",
"formula_reduced": "Tb2IrAu",
"formula_anonymous": "ABC2",
"energy": -24.66481435,
"energy_per_atom": -6.1662035875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -24.66481435,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0038372,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:30.649000Z",
"spacegroup": 225
},
{
"id": "mp-1183723",
"created_at": "2022-09-04T14:44:19.155579Z",
"structure_string": "Cr3 H1\n1.0\n-1.594436 1.594436 3.990248\n1.594436 -1.594436 3.990248\n1.594436 1.594436 -3.990248\nCr H\n3 1\ndirect\n0.750000 0.250000 0.500000 Cr\n0.250000 0.750000 0.500000 Cr\n0.500000 0.500000 0.000000 Cr\n0.000000 0.000000 0.000000 H\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cr",
"H"
],
"chemical_system": "Cr-H",
"density": 6.424869130177965,
"density_atomic": 0.09857934503369359,
"volume": 40.576451371560985,
"volume_molar": 6.108927542520884,
"formula_full": "Cr3 H1",
"formula_reduced": "Cr3H",
"formula_anonymous": "AB3",
"energy": -29.43605671,
"energy_per_atom": -7.3590141775,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -29.25705671,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.1112839,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:25.767000Z",
"spacegroup": 139
},
{
"id": "mp-1184085",
"created_at": "2022-09-04T14:44:11.136929Z",
"structure_string": "Er2 Ag1 Pt1\n1.0\n0.000000 3.519784 3.519784\n3.519784 0.000000 3.519784\n3.519784 3.519784 0.000000\nEr Ag Pt\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Er\n0.250000 0.250000 0.250000 Er\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Er",
"Ag",
"Pt"
],
"chemical_system": "Ag-Er-Pt",
"density": 12.137547736395398,
"density_atomic": 0.04586505908828503,
"volume": 87.21235902695457,
"volume_molar": 13.130127551799427,
"formula_full": "Er2 Ag1 Pt1",
"formula_reduced": "Er2AgPt",
"formula_anonymous": "ABC2",
"energy": -21.29645612,
"energy_per_atom": -5.32411403,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -21.29645612,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0069149,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:28.622000Z",
"spacegroup": 225
},
{
"id": "mp-977394",
"created_at": "2022-09-04T14:44:16.003860Z",
"structure_string": "Tb1 Al1 Ag2\n1.0\n0.000000 3.433082 3.433082\n3.433082 0.000000 3.433082\n3.433082 3.433082 0.000000\nTb Al Ag\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Tb\n0.500000 0.500000 0.500000 Al\n0.750000 0.750000 0.750000 Ag\n0.250000 0.250000 0.250000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tb",
"Al",
"Ag"
],
"chemical_system": "Ag-Al-Tb",
"density": 8.241515615287689,
"density_atomic": 0.04942850388577571,
"volume": 80.92496607309008,
"volume_molar": 12.183538417259323,
"formula_full": "Tb1 Al1 Ag2",
"formula_reduced": "TbAlAg2",
"formula_anonymous": "ABC2",
"energy": -15.3791637,
"energy_per_atom": -3.844790925,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.3791637,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0003948,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:35.811000Z",
"spacegroup": 225
},
{
"id": "mp-862662",
"created_at": "2022-09-04T14:45:11.475424Z",
"structure_string": "La1 Mg1 Zn2\n1.0\n0.000000 3.535850 3.535850\n3.535850 0.000000 3.535850\n3.535850 3.535850 0.000000\nLa Mg Zn\n1 1 2\ndirect\n0.500000 0.500000 0.500000 La\n0.000000 0.000000 0.000000 Mg\n0.250000 0.250000 0.250000 Zn\n0.750000 0.750000 0.750000 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Mg",
"Zn"
],
"chemical_system": "La-Mg-Zn",
"density": 5.52238889889585,
"density_atomic": 0.04524269815382842,
"volume": 88.41205682295325,
"volume_molar": 13.310746276723572,
"formula_full": "La1 Mg1 Zn2",
"formula_reduced": "LaMgZn2",
"formula_anonymous": "ABC2",
"energy": -10.41400847,
"energy_per_atom": -2.6035021175,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -10.41400847,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0109416,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:52.321000Z",
"spacegroup": 225
},
{
"id": "mp-21210",
"created_at": "2022-09-04T14:44:29.861882Z",
"structure_string": "In2 Sb2\n1.0\n3.063314 -3.081373 0.000000\n3.063314 3.081373 0.000000\n0.000000 0.000000 6.126894\nIn Sb\n2 2\ndirect\n0.279411 0.720589 0.250000 In\n0.720589 0.279411 0.750000 In\n0.777205 0.222795 0.250000 Sb\n0.222795 0.777205 0.750000 Sb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"In",
"Sb"
],
"chemical_system": "In-Sb",
"density": 6.792776073614583,
"density_atomic": 0.03458229732316931,
"volume": 115.66611560302837,
"volume_molar": 17.41394073309673,
"formula_full": "In2 Sb2",
"formula_reduced": "InSb",
"formula_anonymous": "AB",
"energy": -14.03286411,
"energy_per_atom": -3.5082160275,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -13.64886411,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0031469,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:38.130000Z",
"spacegroup": 63
},
{
"id": "mp-1095951",
"created_at": "2022-09-04T14:44:25.202673Z",
"structure_string": "Ba1 In1 Hg2\n1.0\n-6.260210 6.853610 9.740363\n6.260210 -6.853610 9.740363\n6.260210 6.853610 -9.740363\nBa In Hg\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Ba\n0.000000 0.000000 0.000000 In\n0.000000 0.230336 0.230336 Hg\n0.000000 0.769664 0.769664 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"In",
"Hg"
],
"chemical_system": "Ba-Hg-In",
"density": 0.6489854369384127,
"density_atomic": 0.0023928560234393868,
"volume": 1671.642573066546,
"volume_molar": 251.6716718853831,
"formula_full": "Ba1 In1 Hg2",
"formula_reduced": "BaInHg2",
"formula_anonymous": "ABC2",
"energy": -2.23820013,
"energy_per_atom": -0.5595500325,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -2.23820013,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 1.0602299,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:35.621000Z",
"spacegroup": 71
},
{
"id": "mp-1184981",
"created_at": "2022-09-04T14:44:25.649995Z",
"structure_string": "Li2 Nd1 Pb1\n1.0\n0.000000 3.514474 3.514474\n3.514474 0.000000 3.514474\n3.514474 3.514474 0.000000\nLi Nd Pb\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Li\n0.750000 0.750000 0.750000 Li\n0.500000 0.500000 0.500000 Nd\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Nd",
"Pb"
],
"chemical_system": "Li-Nd-Pb",
"density": 6.987411200229593,
"density_atomic": 0.04607326516771394,
"volume": 86.81824449470577,
"volume_molar": 13.07079222208033,
"formula_full": "Li2 Nd1 Pb1",
"formula_reduced": "Li2NdPb",
"formula_anonymous": "ABC2",
"energy": -13.68781853,
"energy_per_atom": -3.4219546325,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -13.68781853,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0009391,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:35.193000Z",
"spacegroup": 225
}
]
}