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=-id&page=12156",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-id&page=12154",
"results": [
{
"id": "mp-1008835",
"created_at": "2022-09-04T14:42:59.912297Z",
"structure_string": "Os1 C2\n1.0\n1.435840 -2.486947 0.000000\n1.435840 2.486947 0.000000\n0.000000 0.000000 4.014595\nOs C\n1 2\ndirect\n0.666667 0.333333 0.500000 Os\n0.000000 0.000000 0.819966 C\n0.000000 0.000000 0.180034 C\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Os",
"C"
],
"chemical_system": "C-Os",
"density": 12.408761947172612,
"density_atomic": 0.10463499113055408,
"volume": 28.671097188290208,
"volume_molar": 5.7553794337174615,
"formula_full": "Os1 C2",
"formula_reduced": "OsC2",
"formula_anonymous": "AB2",
"energy": -27.88123268,
"energy_per_atom": -9.293744226666666,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -27.88123268,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 1.55e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:05.536000Z",
"spacegroup": 187
},
{
"id": "mp-1008833",
"created_at": "2022-09-04T14:47:05.840465Z",
"structure_string": "Np1 N2\n1.0\n0.000000 2.611960 2.611960\n2.611960 0.000000 2.611960\n2.611960 2.611960 0.000000\nNp N\n1 2\ndirect\n0.000000 0.000000 0.000000 Np\n0.750000 0.750000 0.750000 N\n0.250000 0.250000 0.250000 N\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Np",
"N"
],
"chemical_system": "N-Np",
"density": 12.347736990768965,
"density_atomic": 0.0841766607857188,
"volume": 35.639332470515065,
"volume_molar": 7.154169224329342,
"formula_full": "Np1 N2",
"formula_reduced": "NpN2",
"formula_anonymous": "AB2",
"energy": -33.20276177,
"energy_per_atom": -11.067587256666668,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -32.48076177,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.0008259,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:56.172000Z",
"spacegroup": 225
},
{
"id": "mp-1008832",
"created_at": "2022-09-04T14:44:04.299584Z",
"structure_string": "Hf1 C1\n1.0\n1.615365 -2.797895 0.000000\n1.615365 2.797895 0.000000\n0.000000 0.000000 2.916530\nHf C\n1 1\ndirect\n0.000000 0.000000 0.000000 Hf\n0.333333 0.666667 0.500000 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Hf",
"C"
],
"chemical_system": "C-Hf",
"density": 11.99905789051877,
"density_atomic": 0.07586325470621812,
"volume": 26.36322430068467,
"volume_molar": 7.938152381308783,
"formula_full": "Hf1 C1",
"formula_reduced": "HfC",
"formula_anonymous": "AB",
"energy": -19.53673797,
"energy_per_atom": -9.768368985,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -19.53673797,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 1.42e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:21.465000Z",
"spacegroup": 187
},
{
"id": "mp-1008826",
"created_at": "2022-09-04T14:40:43.968680Z",
"structure_string": "Os1 N2\n1.0\n0.000000 2.437326 2.437326\n2.437326 0.000000 2.437326\n2.437326 2.437326 0.000000\nOs N\n1 2\ndirect\n0.000000 0.000000 0.000000 Os\n0.750000 0.750000 0.750000 N\n0.250000 0.250000 0.250000 N\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Os",
"N"
],
"chemical_system": "N-Os",
"density": 12.514668690502285,
"density_atomic": 0.10359776714211869,
"volume": 28.95815308340097,
"volume_molar": 5.813002467262288,
"formula_full": "Os1 N2",
"formula_reduced": "OsN2",
"formula_anonymous": "AB2",
"energy": -25.491147840000004,
"energy_per_atom": -8.49704928,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -24.76914784,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0006647,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:09.767000Z",
"spacegroup": 225
},
{
"id": "mp-1008823",
"created_at": "2022-09-04T14:40:08.539792Z",
"structure_string": "Os1 N2\n1.0\n1.371658 -2.912524 0.000000\n1.371658 2.912524 0.000000\n0.000000 0.000000 3.676725\nOs N\n1 2\ndirect\n0.313899 0.686101 0.500000 Os\n0.009702 0.990298 0.813364 N\n0.009702 0.990298 0.186636 N\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Os",
"N"
],
"chemical_system": "N-Os",
"density": 12.336265822852633,
"density_atomic": 0.10212092910530501,
"volume": 29.376936013835728,
"volume_molar": 5.897068125761069,
"formula_full": "Os1 N2",
"formula_reduced": "OsN2",
"formula_anonymous": "AB2",
"energy": -25.964511700000003,
"energy_per_atom": -8.654837233333334,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -25.2425117,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 2.52e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:48.429000Z",
"spacegroup": 38
},
{
"id": "mp-1008820",
"created_at": "2022-09-04T14:39:37.653992Z",
"structure_string": "Pd1 N2\n1.0\n0.000000 2.486518 2.486518\n2.486518 0.000000 2.486518\n2.486518 2.486518 0.000000\nPd N\n1 2\ndirect\n0.000000 0.000000 0.000000 Pd\n0.750000 0.750000 0.750000 N\n0.250000 0.250000 0.250000 N\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Pd",
"N"
],
"chemical_system": "N-Pd",
"density": 7.260248104418468,
"density_atomic": 0.09757002958886853,
"volume": 30.74714656376676,
"volume_molar": 6.172121485845125,
"formula_full": "Pd1 N2",
"formula_reduced": "PdN2",
"formula_anonymous": "AB2",
"energy": -17.60115077,
"energy_per_atom": -5.8670502566666665,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -16.87915077,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.001032,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:29.114000Z",
"spacegroup": 225
},
{
"id": "mp-1008813",
"created_at": "2022-09-04T14:42:04.472143Z",
"structure_string": "Rb1 Ag1 O1\n1.0\n0.000000 3.191521 3.191521\n3.191521 0.000000 3.191521\n3.191521 3.191521 0.000000\nRb Ag O\n1 1 1\ndirect\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Ag\n0.250000 0.250000 0.250000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Rb",
"Ag",
"O"
],
"chemical_system": "Ag-O-Rb",
"density": 5.346488773136841,
"density_atomic": 0.046142183273421206,
"volume": 65.01642937489822,
"volume_molar": 13.051269646941195,
"formula_full": "Rb1 Ag1 O1",
"formula_reduced": "RbAgO",
"formula_anonymous": "ABC",
"energy": -10.13917199,
"energy_per_atom": -3.3797239966666663,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -9.45217199,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 1.5e-06,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:38.978000Z",
"spacegroup": 216
},
{
"id": "mp-1008809",
"created_at": "2022-09-04T14:46:52.303755Z",
"structure_string": "Pt1 N2\n1.0\n1.607513 -2.784295 0.000000\n1.607513 2.784295 0.000000\n0.000000 0.000000 3.917212\nPt N\n1 2\ndirect\n0.333333 0.666667 0.500000 Pt\n0.666667 0.333333 0.847003 N\n0.666667 0.333333 0.152997 N\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Pt",
"N"
],
"chemical_system": "N-Pt",
"density": 10.564934120882995,
"density_atomic": 0.08555481204810704,
"volume": 35.06523979402953,
"volume_molar": 7.038926994093309,
"formula_full": "Pt1 N2",
"formula_reduced": "PtN2",
"formula_anonymous": "AB2",
"energy": -20.69718033,
"energy_per_atom": -6.89906011,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -19.97518033,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 1e-07,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:38.419000Z",
"spacegroup": 187
},
{
"id": "mp-1008807",
"created_at": "2022-09-04T14:44:52.866099Z",
"structure_string": "Rb1 Cu1 O1\n1.0\n0.000000 3.059354 3.059354\n3.059354 0.000000 3.059354\n3.059354 3.059354 0.000000\nRb Cu O\n1 1 1\ndirect\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Cu\n0.250000 0.250000 0.250000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Rb",
"Cu",
"O"
],
"chemical_system": "Cu-O-Rb",
"density": 4.784632555323565,
"density_atomic": 0.05238441059805107,
"volume": 57.26894634778258,
"volume_molar": 11.496055202774487,
"formula_full": "Rb1 Cu1 O1",
"formula_reduced": "RbCuO",
"formula_anonymous": "ABC",
"energy": -10.59931415,
"energy_per_atom": -3.5331047166666667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -9.91231415,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 9.14e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:44.234000Z",
"spacegroup": 216
},
{
"id": "mp-1008806",
"created_at": "2022-09-04T14:46:58.787767Z",
"structure_string": "Re1 C2\n1.0\n-1.390427 1.390427 3.368838\n1.390427 -1.390427 3.368838\n1.390427 1.390427 -3.368838\nRe C\n1 2\ndirect\n0.000000 0.000000 0.000000 Re\n0.666529 0.666529 0.000000 C\n0.333471 0.333471 0.000000 C\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Re",
"C"
],
"chemical_system": "C-Re",
"density": 13.399974714474334,
"density_atomic": 0.11515551743564463,
"volume": 26.051726107492577,
"volume_molar": 5.229572055342906,
"formula_full": "Re1 C2",
"formula_reduced": "ReC2",
"formula_anonymous": "AB2",
"energy": -26.35505247,
"energy_per_atom": -8.78501749,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -26.35505247,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001635,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:46.511000Z",
"spacegroup": 139
},
{
"id": "mp-1008805",
"created_at": "2022-09-04T14:39:26.582892Z",
"structure_string": "Re1 C2\n1.0\n1.439956 -2.494076 0.000000\n1.439956 2.494076 0.000000\n0.000000 0.000000 4.063497\nRe C\n1 2\ndirect\n0.666667 0.333333 0.500000 Re\n0.000000 0.000000 0.829262 C\n0.000000 0.000000 0.170738 C\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Re",
"C"
],
"chemical_system": "C-Re",
"density": 11.960563422508114,
"density_atomic": 0.102785631994739,
"volume": 29.18695873907311,
"volume_molar": 5.858932462767012,
"formula_full": "Re1 C2",
"formula_reduced": "ReC2",
"formula_anonymous": "AB2",
"energy": -29.505831290000003,
"energy_per_atom": -9.835277096666667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -29.505831290000003,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0052208,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:36.597000Z",
"spacegroup": 187
},
{
"id": "mp-1008802",
"created_at": "2022-09-04T14:47:23.454067Z",
"structure_string": "Re1 C2\n1.0\n2.688369 0.000000 0.000000\n0.000000 2.688369 0.000000\n0.000000 0.000000 3.848486\nRe C\n1 2\ndirect\n0.500000 0.500000 0.500000 Re\n0.000000 0.000000 0.815930 C\n0.000000 0.000000 0.184070 C\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Re",
"C"
],
"chemical_system": "C-Re",
"density": 12.550840595415478,
"density_atomic": 0.10785830375158742,
"volume": 27.814270164209283,
"volume_molar": 5.583381668851221,
"formula_full": "Re1 C2",
"formula_reduced": "ReC2",
"formula_anonymous": "AB2",
"energy": -28.21151091,
"energy_per_atom": -9.40383697,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -28.21151091,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0021127,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:04.955000Z",
"spacegroup": 123
}
]
}