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=9",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=density_atomic&page=7",
"results": [
{
"id": "mp-1212335",
"created_at": "2022-09-04T14:41:02.319947Z",
"structure_string": "K2 Li1 Te2\n1.0\n13.935392 0.000000 0.000000\n0.000000 13.935392 0.000000\n0.000000 0.000000 17.140706\nK Li Te\n2 1 2\ndirect\n0.500000 0.500000 0.669055 K\n0.500000 0.500000 0.330945 K\n0.500000 0.500000 0.000000 Li\n0.500000 0.500000 0.151880 Te\n0.500000 0.500000 0.848120 Te\n",
"nsites": 5,
"nelements": 3,
"elements": [
"K",
"Li",
"Te"
],
"chemical_system": "K-Li-Te",
"density": 0.16978211675856136,
"density_atomic": 0.001502114086137043,
"volume": 3328.641976095438,
"volume_molar": 400.91101039382573,
"formula_full": "K2 Li1 Te2",
"formula_reduced": "K2LiTe2",
"formula_anonymous": "AB2C2",
"energy": -11.13928781,
"energy_per_atom": -2.227857562,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -10.29528781,
"band_gap": 0.0001000000000002,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.0024165,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:02.335000Z",
"spacegroup": 123
},
{
"id": "mp-1207258",
"created_at": "2022-09-04T14:45:38.442896Z",
"structure_string": "Dy2 Te3\n1.0\n9.610718 0.000000 0.000000\n0.000000 9.610718 0.000000\n0.000000 0.000000 35.859001\nDy Te\n2 3\ndirect\n0.500000 0.500000 0.284470 Dy\n0.500000 0.500000 0.715530 Dy\n0.500000 0.500000 0.642296 Te\n0.500000 0.500000 0.357704 Te\n0.500000 0.500000 0.000000 Te\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Dy",
"Te"
],
"chemical_system": "Dy-Te",
"density": 0.35485407830645743,
"density_atomic": 0.001509593959847446,
"volume": 3312.1489175177157,
"volume_molar": 398.9245399874663,
"formula_full": "Dy2 Te3",
"formula_reduced": "Dy2Te3",
"formula_anonymous": "A2B3",
"energy": -12.61873073,
"energy_per_atom": -2.5237461459999997,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -11.35273073,
"band_gap": 0.0266999999999999,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.9026843,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:06.775000Z",
"spacegroup": 123
},
{
"id": "mp-1206316",
"created_at": "2022-09-04T14:40:06.028045Z",
"structure_string": "Nd2 Sb3 Au1\n1.0\n9.810151 0.000000 0.000000\n0.000000 9.810151 0.000000\n0.000000 0.000000 41.152353\nNd Sb Au\n2 3 1\ndirect\n0.500000 0.500000 0.242928 Nd\n0.500000 0.500000 0.757072 Nd\n0.500000 0.500000 0.690963 Sb\n0.500000 0.500000 0.309037 Sb\n0.500000 0.500000 0.000000 Sb\n0.500000 0.500000 0.500000 Au\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Nd",
"Sb",
"Au"
],
"chemical_system": "Au-Nd-Sb",
"density": 0.356693404711464,
"density_atomic": 0.0015149740496124616,
"volume": 3960.463878265659,
"volume_molar": 397.5078491635217,
"formula_full": "Nd2 Sb3 Au1",
"formula_reduced": "Nd2Sb3Au",
"formula_anonymous": "AB2C3",
"energy": -12.08233821,
"energy_per_atom": -2.013723035,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -11.50633821,
"band_gap": 0.1213000000000001,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 3.9273462,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:47.382000Z",
"spacegroup": 123
},
{
"id": "mp-1207280",
"created_at": "2022-09-04T14:39:59.175826Z",
"structure_string": "Ho2 Te3\n1.0\n9.591044 0.000000 0.000000\n0.000000 9.591044 0.000000\n0.000000 0.000000 35.792405\nHo Te\n2 3\ndirect\n0.500000 0.500000 0.284468 Ho\n0.500000 0.500000 0.715532 Ho\n0.500000 0.500000 0.642286 Te\n0.500000 0.500000 0.357714 Te\n0.500000 0.500000 0.000000 Te\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Ho",
"Te"
],
"chemical_system": "Ho-Te",
"density": 0.3594257795291503,
"density_atomic": 0.001518613850938421,
"volume": 3292.4762255462583,
"volume_molar": 396.5551055838615,
"formula_full": "Ho2 Te3",
"formula_reduced": "Ho2Te3",
"formula_anonymous": "A2B3",
"energy": -12.81082261,
"energy_per_atom": -2.562164522,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -11.54482261,
"band_gap": 0.092,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 3.5194534,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:43.745000Z",
"spacegroup": 123
},
{
"id": "mp-1206276",
"created_at": "2022-09-04T14:42:27.510203Z",
"structure_string": "Pr2 Sb3 Au1\n1.0\n9.747002 0.000000 0.000000\n0.000000 9.747002 0.000000\n0.000000 0.000000 41.160360\nPr Sb Au\n2 3 1\ndirect\n0.500000 0.500000 0.242759 Pr\n0.500000 0.500000 0.757241 Pr\n0.500000 0.500000 0.690753 Sb\n0.500000 0.500000 0.309247 Sb\n0.500000 0.500000 0.000000 Sb\n0.500000 0.500000 0.500000 Au\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Pr",
"Sb",
"Au"
],
"chemical_system": "Au-Pr-Sb",
"density": 0.3584281442803523,
"density_atomic": 0.001534369564997708,
"volume": 3910.40081664352,
"volume_molar": 392.48306909743707,
"formula_full": "Pr2 Sb3 Au1",
"formula_reduced": "Pr2Sb3Au",
"formula_anonymous": "AB2C3",
"energy": -12.22159749,
"energy_per_atom": -2.036932915,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -11.64559749,
"band_gap": 0.1177000000000001,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 3.9329346,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:51.331000Z",
"spacegroup": 123
},
{
"id": "mp-1097334",
"created_at": "2022-09-04T14:47:15.953287Z",
"structure_string": "K1 Rb1 Na2\n1.0\n-7.645250 7.802594 10.817162\n7.645250 -7.802594 10.817162\n7.645250 7.802594 -10.817162\nK Rb Na\n1 1 2\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.000000 0.500000 Rb\n0.248797 0.000000 0.248797 Na\n0.751203 0.000000 0.751203 Na\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Rb",
"Na"
],
"chemical_system": "K-Na-Rb",
"density": 0.1097199722050012,
"density_atomic": 0.001549729732426282,
"volume": 2581.0952169947304,
"volume_molar": 388.59296779262525,
"formula_full": "K1 Rb1 Na2",
"formula_reduced": "KRbNa2",
"formula_anonymous": "ABC2",
"energy": -2.6816377,
"energy_per_atom": -0.670409425,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -2.6816377,
"band_gap": 0.29,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:05.003000Z",
"spacegroup": 71
},
{
"id": "mp-1206986",
"created_at": "2022-09-04T14:43:15.668117Z",
"structure_string": "Lu2 Te3\n1.0\n9.523692 0.000000 0.000000\n0.000000 9.523692 0.000000\n0.000000 0.000000 35.550539\nLu Te\n2 3\ndirect\n0.500000 0.500000 0.284243 Lu\n0.500000 0.500000 0.715757 Lu\n0.500000 0.500000 0.642129 Te\n0.500000 0.500000 0.357871 Te\n0.500000 0.500000 0.000000 Te\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Lu",
"Te"
],
"chemical_system": "Lu-Te",
"density": 0.37734497269204664,
"density_atomic": 0.0015506476711979807,
"volume": 3224.459103683534,
"volume_molar": 388.3629319449135,
"formula_full": "Lu2 Te3",
"formula_reduced": "Lu2Te3",
"formula_anonymous": "A2B3",
"energy": -12.5163605,
"energy_per_atom": -2.5032721,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -11.2503605,
"band_gap": 0.1543000000000001,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 3.8082747,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:10.509000Z",
"spacegroup": 123
},
{
"id": "mp-1207343",
"created_at": "2022-09-04T14:47:30.406954Z",
"structure_string": "Pa2 P3\n1.0\n9.669870 0.000000 0.000000\n-0.000000 9.669870 0.000000\n-0.000000 0.000000 34.456489\nPa P\n2 3\ndirect\n0.500000 0.500000 0.287271 Pa\n0.500000 0.500000 0.712729 Pa\n0.500000 0.500000 0.645355 P\n0.500000 0.500000 0.354645 P\n0.500000 0.500000 -0.000000 P\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Pa",
"P"
],
"chemical_system": "P-Pa",
"density": 0.286038403665118,
"density_atomic": 0.0015518784808632735,
"volume": 3221.9017543297705,
"volume_molar": 388.05491758929634,
"formula_full": "Pa2 P3",
"formula_reduced": "Pa2P3",
"formula_anonymous": "A2B3",
"energy": -19.74026735,
"energy_per_atom": -3.94805347,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -19.74026735,
"band_gap": 0.1497999999999999,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 0.9993454,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:13.135000Z",
"spacegroup": 123
},
{
"id": "mp-1209649",
"created_at": "2022-09-04T14:47:17.139890Z",
"structure_string": "Sm2 Sb3 Au1\n1.0\n9.738592 0.000000 0.000000\n0.000000 9.738592 0.000000\n0.000000 0.000000 40.639337\nSm Sb Au\n2 3 1\ndirect\n0.500000 0.500000 0.248023 Sm\n0.500000 0.500000 0.751977 Sm\n0.500000 0.500000 0.685791 Sb\n0.500000 0.500000 0.314209 Sb\n0.500000 0.500000 0.000000 Sb\n0.500000 0.500000 0.500000 Au\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sm",
"Sb",
"Au"
],
"chemical_system": "Au-Sb-Sm",
"density": 0.37179548561155823,
"density_atomic": 0.0015567264106096169,
"volume": 3854.2417981142808,
"volume_molar": 386.84644385532835,
"formula_full": "Sm2 Sb3 Au1",
"formula_reduced": "Sm2Sb3Au",
"formula_anonymous": "AB2C3",
"energy": -11.58577626,
"energy_per_atom": -1.93096271,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -11.00977626,
"band_gap": 0.1313999999999997,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 3.8194727,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:03.591000Z",
"spacegroup": 123
},
{
"id": "mp-1206620",
"created_at": "2022-09-04T14:41:08.464715Z",
"structure_string": "Pr2 Cd1 Sb3\n1.0\n9.819627 0.000000 0.000000\n0.000000 9.819627 0.000000\n0.000000 0.000000 39.956455\nPr Cd Sb\n2 1 3\ndirect\n0.500000 0.500000 0.241415 Pr\n0.500000 0.500000 0.758585 Pr\n0.500000 0.500000 0.500000 Cd\n0.500000 0.500000 0.690191 Sb\n0.500000 0.500000 0.309809 Sb\n0.500000 0.500000 0.000000 Sb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Pr",
"Cd",
"Sb"
],
"chemical_system": "Cd-Pr-Sb",
"density": 0.32734336716641094,
"density_atomic": 0.0015573072939169016,
"volume": 3852.804146899579,
"volume_molar": 386.7021482223497,
"formula_full": "Pr2 Cd1 Sb3",
"formula_reduced": "Pr2CdSb3",
"formula_anonymous": "AB2C3",
"energy": -12.03534247,
"energy_per_atom": -2.0058904116666665,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -11.45934247,
"band_gap": 0.1200999999999998,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 3.1721503,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:08.106000Z",
"spacegroup": 123
},
{
"id": "mp-1207358",
"created_at": "2022-09-04T14:44:53.689689Z",
"structure_string": "Tm2 Cu1 Sb3\n1.0\n9.789968 0.000000 0.000000\n0.000000 9.789968 0.000000\n0.000000 0.000000 40.154362\nTm Cu Sb\n2 1 3\ndirect\n0.500000 0.500000 0.243464 Tm\n0.500000 0.500000 0.756536 Tm\n0.500000 0.500000 0.500000 Cu\n0.500000 0.500000 0.691465 Sb\n0.500000 0.500000 0.308535 Sb\n0.500000 0.500000 0.000000 Sb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tm",
"Cu",
"Sb"
],
"chemical_system": "Cu-Sb-Tm",
"density": 0.3308080928303118,
"density_atomic": 0.0015590353979044772,
"volume": 3848.5335278882635,
"volume_molar": 386.27351040870843,
"formula_full": "Tm2 Cu1 Sb3",
"formula_reduced": "Tm2CuSb3",
"formula_anonymous": "AB2C3",
"energy": -11.09717812,
"energy_per_atom": -1.8495296866666668,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -10.52117812,
"band_gap": 0.0928,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 3.8251252,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:45.817000Z",
"spacegroup": 123
},
{
"id": "mp-1206966",
"created_at": "2022-09-04T14:46:36.005758Z",
"structure_string": "Tm2 Te3\n1.0\n9.473164 0.000000 0.000000\n0.000000 9.473164 0.000000\n0.000000 0.000000 35.693107\nTm Te\n2 3\ndirect\n0.500000 0.500000 0.284368 Tm\n0.500000 0.500000 0.715632 Tm\n0.500000 0.500000 0.642263 Te\n0.500000 0.500000 0.357737 Te\n0.500000 0.500000 0.000000 Te\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Tm",
"Te"
],
"chemical_system": "Te-Tm",
"density": 0.3736028007161054,
"density_atomic": 0.0015609735299766077,
"volume": 3203.1292677172614,
"volume_molar": 385.79390645338145,
"formula_full": "Tm2 Te3",
"formula_reduced": "Tm2Te3",
"formula_anonymous": "A2B3",
"energy": -12.20265057,
"energy_per_atom": -2.440530114,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -10.93665057,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 3.9999219,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:42.098000Z",
"spacegroup": 123
}
]
}