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=21",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=nsites&page=19",
"results": [
{
"id": "mp-1748",
"created_at": "2022-09-04T14:40:32.138498Z",
"structure_string": "Nd1 S1\n1.0\n0.000000 2.876973 2.876973\n2.876973 0.000000 2.876973\n2.876973 2.876973 0.000000\nNd S\n1 1\ndirect\n0.000000 0.000000 0.000000 Nd\n0.500000 0.500000 0.500000 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Nd",
"S"
],
"chemical_system": "Nd-S",
"density": 6.147255994060428,
"density_atomic": 0.04199452193818602,
"volume": 47.625259383685965,
"volume_molar": 14.340300787003386,
"formula_full": "Nd1 S1",
"formula_reduced": "NdS",
"formula_anonymous": "AB",
"energy": -13.4559501,
"energy_per_atom": -6.72797505,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.9529501,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0011491,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:04.726000Z",
"spacegroup": 225
},
{
"id": "mp-20298",
"created_at": "2022-09-04T14:40:28.532824Z",
"structure_string": "Sm1 In1\n1.0\n3.839327 0.000000 0.000000\n0.000000 3.839327 0.000000\n0.000000 0.000000 3.839327\nSm In\n1 1\ndirect\n0.500000 0.500000 0.500000 Sm\n0.000000 0.000000 0.000000 In\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sm",
"In"
],
"chemical_system": "In-Sm",
"density": 7.78074673315605,
"density_atomic": 0.035339848751531865,
"volume": 56.593337851037255,
"volume_molar": 17.040652330859114,
"formula_full": "Sm1 In1",
"formula_reduced": "SmIn",
"formula_anonymous": "AB",
"energy": -8.43884027,
"energy_per_atom": -4.219420135,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.43884027,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0013278,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:48.624000Z",
"spacegroup": 221
},
{
"id": "mp-771",
"created_at": "2022-09-04T14:40:32.546460Z",
"structure_string": "Mn1 Al1\n1.0\n2.753065 0.000000 0.000000\n0.000000 2.753065 0.000000\n0.000000 0.000000 3.499926\nMn Al\n1 1\ndirect\n0.500000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 Al\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mn",
"Al"
],
"chemical_system": "Al-Mn",
"density": 5.127964867313004,
"density_atomic": 0.07539424615426282,
"volume": 26.527223256637324,
"volume_molar": 7.987533621170778,
"formula_full": "Mn1 Al1",
"formula_reduced": "MnAl",
"formula_anonymous": "AB",
"energy": -13.45216261,
"energy_per_atom": -6.726081305,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -13.45216261,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.3229716,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:54.651000Z",
"spacegroup": 123
},
{
"id": "mp-1261",
"created_at": "2022-09-04T14:40:26.323059Z",
"structure_string": "Eu1 Zn1\n1.0\n3.766259 0.000000 0.000000\n0.000000 3.766259 0.000000\n0.000000 0.000000 3.766259\nEu Zn\n1 1\ndirect\n0.000000 0.000000 0.000000 Eu\n0.500000 0.500000 0.500000 Zn\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Eu",
"Zn"
],
"chemical_system": "Eu-Zn",
"density": 6.7565368412729745,
"density_atomic": 0.03743686283239668,
"volume": 53.423279855310504,
"volume_molar": 16.086125557477615,
"formula_full": "Eu1 Zn1",
"formula_reduced": "EuZn",
"formula_anonymous": "AB",
"energy": -12.06324348,
"energy_per_atom": -6.03162174,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.06324348,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.1334676,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:05.025000Z",
"spacegroup": 221
},
{
"id": "mp-20379",
"created_at": "2022-09-04T14:40:42.721891Z",
"structure_string": "Dy1 Th1\n1.0\n4.007679 0.000000 0.000000\n0.000000 4.007679 0.000000\n0.000000 0.000000 4.007679\nDy Th\n1 1\ndirect\n0.000000 0.000000 0.000000 Dy\n0.500000 0.500000 0.500000 Th\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Dy",
"Th"
],
"chemical_system": "Dy-Th",
"density": 10.177924279235294,
"density_atomic": 0.031070712252885314,
"volume": 64.36930005729992,
"volume_molar": 19.38204927838681,
"formula_full": "Dy1 Th1",
"formula_reduced": "DyTh",
"formula_anonymous": "AB",
"energy": -11.72569729,
"energy_per_atom": -5.862848645,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -11.72569729,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001135,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:12.281000Z",
"spacegroup": 221
},
{
"id": "mp-143",
"created_at": "2022-09-04T14:40:26.215768Z",
"structure_string": "Tm2\n1.0\n1.781323 -3.085341 0.000000\n1.781323 3.085341 0.000000\n0.000000 0.000000 5.513155\nTm\n2\ndirect\n0.333333 0.666667 0.250000 Tm\n0.666667 0.333333 0.750000 Tm\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Tm"
],
"chemical_system": "Tm",
"density": 9.258074136749464,
"density_atomic": 0.03300304043644443,
"volume": 60.60047721516743,
"volume_molar": 18.247230195645557,
"formula_full": "Tm2",
"formula_reduced": "Tm",
"formula_anonymous": "A",
"energy": -8.94449395,
"energy_per_atom": -4.472246975,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.94449395,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.4632692,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:48.664000Z",
"spacegroup": 194
},
{
"id": "mp-32880",
"created_at": "2022-09-04T14:40:33.966108Z",
"structure_string": "Cu1 Br1\n1.0\n-2.047538 2.047538 2.766344\n2.047538 -2.047538 2.766344\n2.047538 2.047538 -2.766344\nCu Br\n1 1\ndirect\n0.250000 0.750000 0.500000 Cu\n0.000000 0.000000 0.000000 Br\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Cu",
"Br"
],
"chemical_system": "Br-Cu",
"density": 5.134752715060553,
"density_atomic": 0.043112169576260545,
"volume": 46.39061359373776,
"volume_molar": 13.968540250212913,
"formula_full": "Cu1 Br1",
"formula_reduced": "CuBr",
"formula_anonymous": "AB",
"energy": -6.769294009999999,
"energy_per_atom": -3.3846470049999997,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -6.23529401,
"band_gap": 0.4449000000000001,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0001354,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:00.362000Z",
"spacegroup": 119
},
{
"id": "mp-1018029",
"created_at": "2022-09-04T14:40:23.719614Z",
"structure_string": "Cu1 Pd1\n1.0\n3.018131 0.000000 0.000000\n0.000000 3.018131 0.000000\n0.000000 0.000000 3.018131\nCu Pd\n1 1\ndirect\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.500000 Pd\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Cu",
"Pd"
],
"chemical_system": "Cu-Pd",
"density": 10.265896771562437,
"density_atomic": 0.07274710872450155,
"volume": 27.492501558709936,
"volume_molar": 8.278185711553531,
"formula_full": "Cu1 Pd1",
"formula_reduced": "CuPd",
"formula_anonymous": "AB",
"energy": -9.52528325,
"energy_per_atom": -4.762641625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -9.52528325,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0012978,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:52.361000Z",
"spacegroup": 221
},
{
"id": "mp-256",
"created_at": "2022-09-04T14:48:31.151858Z",
"structure_string": "La1 N1\n1.0\n0.000000 2.654574 2.654574\n2.654574 0.000000 2.654574\n2.654574 2.654574 0.000000\nLa N\n1 1\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.500000 N\n",
"nsites": 2,
"nelements": 2,
"elements": [
"La",
"N"
],
"chemical_system": "La-N",
"density": 6.786981166317754,
"density_atomic": 0.053458342698503365,
"volume": 37.412308332858075,
"volume_molar": 11.265109346849613,
"formula_full": "La1 N1",
"formula_reduced": "LaN",
"formula_anonymous": "AB",
"energy": -16.24841847,
"energy_per_atom": -8.124209235,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.88741847,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001702,
"is_theoretical": false,
"updated_at": "2021-11-28T01:39:52.827000Z",
"spacegroup": 225
},
{
"id": "mp-8373",
"created_at": "2022-09-04T14:40:22.412093Z",
"structure_string": "Ge1 P1\n1.0\n0.000000 2.862687 2.862687\n2.862687 0.000000 2.862687\n2.862687 2.862687 0.000000\nGe P\n1 1\ndirect\n0.000000 0.000000 0.000000 Ge\n0.250000 0.250000 0.250000 P\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ge",
"P"
],
"chemical_system": "Ge-P",
"density": 3.667034084876429,
"density_atomic": 0.04262637513050668,
"volume": 46.91930744466816,
"volume_molar": 14.12773368967538,
"formula_full": "Ge1 P1",
"formula_reduced": "GeP",
"formula_anonymous": "AB",
"energy": -9.50460622,
"energy_per_atom": -4.75230311,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -9.50460622,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0108461,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:01.426000Z",
"spacegroup": 216
},
{
"id": "mp-1226170",
"created_at": "2022-09-04T14:40:21.448278Z",
"structure_string": "Cr1 Rh1\n1.0\n1.336479 -2.314849 0.000000\n1.336479 2.314849 0.000000\n0.000000 0.000000 4.219386\nCr Rh\n1 1\ndirect\n0.666667 0.333333 0.500000 Cr\n0.333333 0.666667 0.000000 Rh\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Cr",
"Rh"
],
"chemical_system": "Cr-Rh",
"density": 9.85237519211128,
"density_atomic": 0.07660655570727504,
"volume": 26.10742620569309,
"volume_molar": 7.861129774599827,
"formula_full": "Cr1 Rh1",
"formula_reduced": "CrRh",
"formula_anonymous": "AB",
"energy": -17.00969968,
"energy_per_atom": -8.50484984,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -17.00969968,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0038215,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:53.949000Z",
"spacegroup": 187
},
{
"id": "mp-10902",
"created_at": "2022-09-04T14:40:17.856643Z",
"structure_string": "Pr1 Al1\n1.0\n3.753778 0.000000 0.000000\n0.000000 3.753778 0.000000\n0.000000 0.000000 3.753778\nPr Al\n1 1\ndirect\n0.500000 0.500000 0.500000 Pr\n0.000000 0.000000 0.000000 Al\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pr",
"Al"
],
"chemical_system": "Al-Pr",
"density": 5.270673009531453,
"density_atomic": 0.03781152918657939,
"volume": 52.893920003369466,
"volume_molar": 15.926731580423528,
"formula_full": "Pr1 Al1",
"formula_reduced": "PrAl",
"formula_anonymous": "AB",
"energy": -9.19769448,
"energy_per_atom": -4.59884724,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -9.19769448,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0003199,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:02.602000Z",
"spacegroup": 221
}
]
}