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=density_atomic&page=154",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=density_atomic&page=152",
"results": [
{
"id": "mp-1097587",
"created_at": "2022-09-04T14:40:31.051405Z",
"structure_string": "Zr1 Nb1 Ru2\n1.0\n-4.493014 5.585171 7.688685\n4.493014 -5.585171 7.688685\n4.493014 5.585171 -7.688685\nZr Nb Ru\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Zr\n0.000000 0.500000 0.500000 Nb\n0.000000 0.254837 0.254837 Ru\n0.000000 0.745163 0.745163 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Nb",
"Ru"
],
"chemical_system": "Nb-Ru-Zr",
"density": 0.83110175281714,
"density_atomic": 0.0051829102123514305,
"volume": 771.7671802354537,
"volume_molar": 116.1922648331548,
"formula_full": "Zr1 Nb1 Ru2",
"formula_reduced": "ZrNbRu2",
"formula_anonymous": "ABC2",
"energy": -23.60511061,
"energy_per_atom": -5.9012776525,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -23.60511061,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.2404786,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:56.766000Z",
"spacegroup": 71
},
{
"id": "mp-1096454",
"created_at": "2022-09-04T14:44:04.640592Z",
"structure_string": "Ti2 Pt1 W1\n1.0\n-4.680808 5.398195 7.633213\n4.680808 -5.398195 7.633213\n4.680808 5.398195 -7.633213\nTi Pt W\n2 1 1\ndirect\n0.000000 0.241921 0.241921 Ti\n0.000000 0.758079 0.758079 Ti\n0.000000 0.500000 0.500000 Pt\n0.000000 0.000000 0.000000 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Pt",
"W"
],
"chemical_system": "Pt-Ti-W",
"density": 1.0216288154642845,
"density_atomic": 0.005184695113807518,
"volume": 771.5014889395288,
"volume_molar": 116.15226407358564,
"formula_full": "Ti2 Pt1 W1",
"formula_reduced": "Ti2PtW",
"formula_anonymous": "ABC2",
"energy": -21.85809019,
"energy_per_atom": -5.4645225475,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -21.85809019,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 4.0001751,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:30.897000Z",
"spacegroup": 71
},
{
"id": "mp-1096453",
"created_at": "2022-09-04T14:42:05.414585Z",
"structure_string": "Cu1 Pd2 Au1\n1.0\n-4.878544 5.184431 7.624853\n4.878544 -5.184431 7.624853\n4.878544 5.184431 -7.624853\nCu Pd Au\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Cu\n0.000000 0.238667 0.238667 Pd\n0.000000 0.761333 0.761333 Pd\n0.000000 0.500000 0.500000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cu",
"Pd",
"Au"
],
"chemical_system": "Au-Cu-Pd",
"density": 1.0189457078068809,
"density_atomic": 0.005185339540287923,
"volume": 771.4056078529999,
"volume_molar": 116.13782883860316,
"formula_full": "Cu1 Pd2 Au1",
"formula_reduced": "CuPd2Au",
"formula_anonymous": "ABC2",
"energy": -9.38705531,
"energy_per_atom": -2.3467638275,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -9.38705531,
"band_gap": 0.2665999999999995,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.9999339,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:35.566000Z",
"spacegroup": 71
},
{
"id": "mp-1097387",
"created_at": "2022-09-04T14:44:09.003594Z",
"structure_string": "Li2 Rh1 Au1\n1.0\n-4.955506 5.243772 7.420079\n4.955506 -5.243772 7.420079\n4.955506 5.243772 -7.420079\nLi Rh Au\n2 1 1\ndirect\n0.000000 0.250226 0.250226 Li\n0.000000 0.749774 0.749774 Li\n0.000000 0.000000 0.000000 Rh\n0.000000 0.500000 0.500000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Rh",
"Au"
],
"chemical_system": "Au-Li-Rh",
"density": 0.6755198842822722,
"density_atomic": 0.005186324236301897,
"volume": 771.259145735978,
"volume_molar": 116.11577845148534,
"formula_full": "Li2 Rh1 Au1",
"formula_reduced": "Li2RhAu",
"formula_anonymous": "ABC2",
"energy": -9.31979925,
"energy_per_atom": -2.3299498125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -9.31979925,
"band_gap": 0.7466000000000004,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.9998647,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:32.885000Z",
"spacegroup": 71
},
{
"id": "mp-1097213",
"created_at": "2022-09-04T14:48:19.543010Z",
"structure_string": "Ta1 Tc2 Ge1\n1.0\n-4.629463 5.428267 7.672457\n4.629463 -5.428267 7.672457\n4.629463 5.428267 -7.672457\nTa Tc Ge\n1 2 1\ndirect\n0.000000 0.500000 0.500000 Ta\n0.000000 0.258692 0.258692 Tc\n0.000000 0.741308 0.741308 Tc\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ta",
"Tc",
"Ge"
],
"chemical_system": "Ge-Ta-Tc",
"density": 0.9680045962764146,
"density_atomic": 0.0051864920710212,
"volume": 771.2341878144268,
"volume_molar": 116.11202094856887,
"formula_full": "Ta1 Tc2 Ge1",
"formula_reduced": "TaTc2Ge",
"formula_anonymous": "ABC2",
"energy": -23.1654486,
"energy_per_atom": -5.79136215,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -23.1654486,
"band_gap": 0.2671999999999999,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.9999597,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:54.069000Z",
"spacegroup": 71
},
{
"id": "mp-1097592",
"created_at": "2022-09-04T14:46:03.651594Z",
"structure_string": "Nb1 Re1 Mo2\n1.0\n-4.573664 5.444526 7.739977\n4.573664 -5.444526 7.739977\n4.573664 5.444526 -7.739977\nNb Re Mo\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Nb\n0.000000 0.500000 0.500000 Re\n0.000000 0.251765 0.251765 Mo\n0.000000 0.748235 0.748235 Mo\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Nb",
"Re",
"Mo"
],
"chemical_system": "Mo-Nb-Re",
"density": 1.0144716302919645,
"density_atomic": 0.005188430424865956,
"volume": 770.9460612268576,
"volume_molar": 116.06864247689288,
"formula_full": "Nb1 Re1 Mo2",
"formula_reduced": "NbReMo2",
"formula_anonymous": "ABC2",
"energy": -26.07826944,
"energy_per_atom": -6.51956736,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -26.07826944,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.4192974,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:16.226000Z",
"spacegroup": 71
},
{
"id": "mp-1096279",
"created_at": "2022-09-04T14:48:10.116261Z",
"structure_string": "Nb1 Tc1 W2\n1.0\n-4.558866 5.352047 7.896380\n4.558866 -5.352047 7.896380\n4.558866 5.352047 -7.896380\nNb Tc W\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Nb\n0.000000 0.500000 0.500000 Tc\n0.000000 0.254068 0.254068 W\n0.000000 0.745932 0.745932 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Nb",
"Tc",
"W"
],
"chemical_system": "Nb-Tc-W",
"density": 1.2035791694234979,
"density_atomic": 0.005190332908995733,
"volume": 770.6634757603539,
"volume_molar": 116.02609824049247,
"formula_full": "Nb1 Tc1 W2",
"formula_reduced": "NbTcW2",
"formula_anonymous": "ABC2",
"energy": -27.05584626,
"energy_per_atom": -6.763961565,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -27.05584626,
"band_gap": 0.0415999999999998,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.5908336,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:35.415000Z",
"spacegroup": 71
},
{
"id": "mp-1095821",
"created_at": "2022-09-04T14:40:41.050694Z",
"structure_string": "Ti2 Cr1 Co1\n1.0\n-4.946828 5.263248 7.399021\n4.946828 -5.263248 7.399021\n4.946828 5.263248 -7.399021\nTi Cr Co\n2 1 1\ndirect\n0.000000 0.292079 0.292079 Ti\n0.000000 0.707921 0.707921 Ti\n0.000000 0.000000 0.000000 Cr\n0.000000 0.500000 0.500000 Co\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Cr",
"Co"
],
"chemical_system": "Co-Cr-Ti",
"density": 0.4453459951384875,
"density_atomic": 0.005190929082115075,
"volume": 770.5749658152095,
"volume_molar": 116.0127727567845,
"formula_full": "Ti2 Cr1 Co1",
"formula_reduced": "Ti2CrCo",
"formula_anonymous": "ABC2",
"energy": -19.8229506,
"energy_per_atom": -4.95573765,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -19.8229506,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 9.0009659,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:06.659000Z",
"spacegroup": 71
},
{
"id": "mp-1097502",
"created_at": "2022-09-04T14:39:41.147968Z",
"structure_string": "Ti1 Al1 Tc2\n1.0\n-4.685216 5.391864 7.625583\n4.685216 -5.391864 7.625583\n4.685216 5.391864 -7.625583\nTi Al Tc\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Al\n0.000000 0.267729 0.267729 Tc\n0.000000 0.732271 0.732271 Tc\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Al",
"Tc"
],
"chemical_system": "Al-Tc-Ti",
"density": 0.5836789125604519,
"density_atomic": 0.005191088110670694,
"volume": 770.5513593147614,
"volume_molar": 116.00921871507074,
"formula_full": "Ti1 Al1 Tc2",
"formula_reduced": "TiAlTc2",
"formula_anonymous": "ABC2",
"energy": -19.78092521,
"energy_per_atom": -4.9452313025,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -19.78092521,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 3.9278999,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:43.282000Z",
"spacegroup": 71
},
{
"id": "mp-1097622",
"created_at": "2022-09-04T14:48:01.498836Z",
"structure_string": "Ti2 Nb1 Al1\n1.0\n-4.937004 5.336474 7.311555\n4.937004 -5.336474 7.311555\n4.937004 5.336474 -7.311555\nTi Nb Al\n2 1 1\ndirect\n0.000000 0.273938 0.273938 Ti\n0.000000 0.726062 0.726062 Ti\n0.000000 0.500000 0.500000 Nb\n0.000000 0.000000 0.000000 Al\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Nb",
"Al"
],
"chemical_system": "Al-Nb-Ti",
"density": 0.4646804315680439,
"density_atomic": 0.005191255112572521,
"volume": 770.5265707925889,
"volume_molar": 116.00548671582689,
"formula_full": "Ti2 Nb1 Al1",
"formula_reduced": "Ti2NbAl",
"formula_anonymous": "ABC2",
"energy": -16.29663557,
"energy_per_atom": -4.0741588925,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -16.29663557,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 4.6704126,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:29.132000Z",
"spacegroup": 71
},
{
"id": "mp-1097184",
"created_at": "2022-09-04T14:46:35.500861Z",
"structure_string": "Ta1 Mn2 V1\n1.0\n-5.072119 5.125395 7.408453\n5.072119 -5.125395 7.408453\n5.072119 5.125395 -7.408453\nTa Mn V\n1 2 1\ndirect\n0.500000 0.000000 0.500000 Ta\n0.726884 0.000000 0.726884 Mn\n0.273116 0.000000 0.273116 Mn\n0.000000 0.000000 0.000000 V\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ta",
"Mn",
"V"
],
"chemical_system": "Mn-Ta-V",
"density": 0.7366699981473097,
"density_atomic": 0.005192251193832003,
"volume": 770.3787530063441,
"volume_molar": 115.98323222793694,
"formula_full": "Ta1 Mn2 V1",
"formula_reduced": "TaMn2V",
"formula_anonymous": "ABC2",
"energy": -23.96958878,
"energy_per_atom": -5.992397195,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -23.96958878,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 9.1891915,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:41.890000Z",
"spacegroup": 71
},
{
"id": "mp-1096102",
"created_at": "2022-09-04T14:45:05.496565Z",
"structure_string": "Ti2 Cu1 Re1\n1.0\n-4.759313 5.353092 7.557719\n4.759313 -5.353092 7.557719\n4.759313 5.353092 -7.557719\nTi Cu Re\n2 1 1\ndirect\n0.000000 0.270329 0.270329 Ti\n0.000000 0.729671 0.729671 Ti\n0.000000 0.000000 0.000000 Cu\n0.000000 0.500000 0.500000 Re\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Cu",
"Re"
],
"chemical_system": "Cu-Re-Ti",
"density": 0.7448710597428033,
"density_atomic": 0.00519350177734236,
"volume": 770.1932475407559,
"volume_molar": 115.95530372729891,
"formula_full": "Ti2 Cu1 Re1",
"formula_reduced": "Ti2CuRe",
"formula_anonymous": "ABC2",
"energy": -19.46922209,
"energy_per_atom": -4.8673055225,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -19.46922209,
"band_gap": 0.2406999999999999,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.9993415,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:52.368000Z",
"spacegroup": 71
}
]
}