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=energy_uncorrected&page=11536",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=energy_uncorrected&page=11534",
"results": [
{
"id": "mp-1187289",
"created_at": "2022-09-04T14:47:27.348765Z",
"structure_string": "Sr3 Eu1\n1.0\n-2.987545 2.987545 5.949094\n2.987545 -2.987545 5.949094\n2.987545 2.987545 -5.949094\nSr Eu\n3 1\ndirect\n0.750000 0.250000 0.500000 Sr\n0.250000 0.750000 0.500000 Sr\n0.500000 0.500000 0.000000 Sr\n0.000000 0.000000 0.000000 Eu\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sr",
"Eu"
],
"chemical_system": "Eu-Sr",
"density": 3.2431963214217245,
"density_atomic": 0.018833032579277303,
"volume": 212.39277228253462,
"volume_molar": 31.976479277301255,
"formula_full": "Sr3 Eu1",
"formula_reduced": "Sr3Eu",
"formula_anonymous": "AB3",
"energy": -15.22628706,
"energy_per_atom": -3.806571765,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.22628706,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.3001805,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:07.674000Z",
"spacegroup": 139
},
{
"id": "mp-973636",
"created_at": "2022-09-04T14:39:28.647868Z",
"structure_string": "Lu2 Zn1 Ga1\n1.0\n0.000000 3.493224 3.493224\n3.493224 0.000000 3.493224\n3.493224 3.493224 0.000000\nLu Zn Ga\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Lu\n0.750000 0.750000 0.750000 Lu\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Lu",
"Zn",
"Ga"
],
"chemical_system": "Ga-Lu-Zn",
"density": 9.448016224033845,
"density_atomic": 0.04691920985891239,
"volume": 85.2529275754671,
"volume_molar": 12.835128251538709,
"formula_full": "Lu2 Zn1 Ga1",
"formula_reduced": "Lu2ZnGa",
"formula_anonymous": "ABC2",
"energy": -15.22498265,
"energy_per_atom": -3.8062456625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.22498265,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0037778,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:24.738000Z",
"spacegroup": 225
},
{
"id": "mp-1187222",
"created_at": "2022-09-04T14:44:05.498571Z",
"structure_string": "Sr3 Eu1\n1.0\n5.982964 0.000000 0.000000\n0.000000 5.982964 0.000000\n0.000000 0.000000 5.982964\nSr Eu\n3 1\ndirect\n0.000000 0.500000 0.500000 Sr\n0.500000 0.000000 0.500000 Sr\n0.500000 0.500000 0.000000 Sr\n0.000000 0.000000 0.000000 Eu\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sr",
"Eu"
],
"chemical_system": "Eu-Sr",
"density": 3.2163537122920367,
"density_atomic": 0.018677159273392873,
"volume": 214.16533111104985,
"volume_molar": 32.24334424656873,
"formula_full": "Sr3 Eu1",
"formula_reduced": "Sr3Eu",
"formula_anonymous": "AB3",
"energy": -15.22410168,
"energy_per_atom": -3.80602542,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.22410168,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.0099348,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:29.166000Z",
"spacegroup": 221
},
{
"id": "mp-980426",
"created_at": "2022-09-04T14:46:58.793239Z",
"structure_string": "Tm1 Al1 Ag2\n1.0\n0.000000 3.394857 3.394857\n3.394857 0.000000 3.394857\n3.394857 3.394857 0.000000\nTm Al Ag\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Tm\n0.500000 0.500000 0.500000 Al\n0.250000 0.250000 0.250000 Ag\n0.750000 0.750000 0.750000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tm",
"Al",
"Ag"
],
"chemical_system": "Ag-Al-Tm",
"density": 8.73544496840805,
"density_atomic": 0.05111702139592968,
"volume": 78.25182083709028,
"volume_molar": 11.781086995181468,
"formula_full": "Tm1 Al1 Ag2",
"formula_reduced": "TmAlAg2",
"formula_anonymous": "ABC2",
"energy": -15.22357114,
"energy_per_atom": -3.805892785,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.22357114,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.001292,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:44.101000Z",
"spacegroup": 225
},
{
"id": "mp-1187007",
"created_at": "2022-09-04T14:44:30.642086Z",
"structure_string": "Si1 Pb3\n1.0\n-2.406713 2.406713 4.884570\n2.406713 -2.406713 4.884570\n2.406713 2.406713 -4.884570\nSi Pb\n1 3\ndirect\n0.000000 0.000000 0.000000 Si\n0.750000 0.250000 0.500000 Pb\n0.250000 0.750000 0.500000 Pb\n0.500000 0.500000 0.000000 Pb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Si",
"Pb"
],
"chemical_system": "Pb-Si",
"density": 9.53273092789357,
"density_atomic": 0.035344761423685325,
"volume": 113.17094355373155,
"volume_molar": 17.03828380056465,
"formula_full": "Si1 Pb3",
"formula_reduced": "SiPb3",
"formula_anonymous": "AB3",
"energy": -15.22218967,
"energy_per_atom": -3.8055474175,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.22218967,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 9.83e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:43.366000Z",
"spacegroup": 139
},
{
"id": "mp-1185101",
"created_at": "2022-09-04T14:48:17.590622Z",
"structure_string": "La1 Y1 Zn2\n1.0\n0.000000 3.682143 3.682143\n3.682143 0.000000 3.682143\n3.682143 3.682143 0.000000\nLa Y Zn\n1 1 2\ndirect\n0.500000 0.500000 0.500000 La\n0.000000 0.000000 0.000000 Y\n0.250000 0.250000 0.250000 Zn\n0.750000 0.750000 0.750000 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Y",
"Zn"
],
"chemical_system": "La-Y-Zn",
"density": 5.964347546770182,
"density_atomic": 0.040061577208046754,
"volume": 99.84629360015715,
"volume_molar": 15.032210860610839,
"formula_full": "La1 Y1 Zn2",
"formula_reduced": "LaYZn2",
"formula_anonymous": "ABC2",
"energy": -15.22135701,
"energy_per_atom": -3.8053392525,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.22135701,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.1434391,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:54.472000Z",
"spacegroup": 225
},
{
"id": "mp-1094486",
"created_at": "2022-09-04T14:42:10.489058Z",
"structure_string": "Mg5 Ti1\n1.0\n1.551738 5.806266 0.000000\n-1.551738 5.806266 0.000000\n0.000000 1.891576 7.218984\nMg Ti\n5 1\ndirect\n0.001823 0.001823 0.007527 Mg\n0.333172 0.333172 0.330989 Mg\n0.946807 0.946807 0.606361 Mg\n0.665835 0.665835 0.659607 Mg\n0.274703 0.274703 0.950359 Mg\n0.610992 0.610992 0.278490 Ti\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Ti"
],
"chemical_system": "Mg-Ti",
"density": 2.1623231335451614,
"density_atomic": 0.04612430675585612,
"volume": 130.083255923152,
"volume_molar": 13.056327961472086,
"formula_full": "Mg5 Ti1",
"formula_reduced": "Mg5Ti",
"formula_anonymous": "AB5",
"energy": -15.220502460000002,
"energy_per_atom": -2.5367504100000002,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.220502460000002,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.7384467,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:39.073000Z",
"spacegroup": 8
},
{
"id": "mp-1182783",
"created_at": "2022-09-04T14:39:33.480353Z",
"structure_string": "Bi2 Te3\n1.0\n1.022711 6.375158 28.483073\n-3.461937 4.019199 8.793587\n-1.848092 -5.649681 -13.642466\nBi Te\n2 3\ndirect\n0.240522 0.520504 0.000000 Bi\n0.759478 0.479496 0.000000 Bi\n0.000000 0.000000 0.000000 Te\n0.405872 0.322199 0.000000 Te\n0.594128 0.677801 0.000000 Te\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Bi",
"Te"
],
"chemical_system": "Bi-Te",
"density": 3.707019180940313,
"density_atomic": 0.013939363237659258,
"volume": 358.69644220847607,
"volume_molar": 43.20240930181296,
"formula_full": "Bi2 Te3",
"formula_reduced": "Bi2Te3",
"formula_anonymous": "A2B3",
"energy": -16.48500332,
"energy_per_atom": -3.297000664,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.21900332,
"band_gap": 0.4617,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0018304,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:27.876000Z",
"spacegroup": 12
},
{
"id": "mp-1001824",
"created_at": "2022-09-04T14:39:13.161323Z",
"structure_string": "Ir1 C1\n1.0\n0.000000 2.203378 2.203378\n2.203378 0.000000 2.203378\n2.203378 2.203378 0.000000\nIr C\n1 1\ndirect\n0.000000 0.000000 0.000000 Ir\n0.500000 0.500000 0.500000 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ir",
"C"
],
"chemical_system": "C-Ir",
"density": 15.851367020381009,
"density_atomic": 0.09348307155997435,
"volume": 21.394247820760725,
"volume_molar": 6.441958591547218,
"formula_full": "Ir1 C1",
"formula_reduced": "IrC",
"formula_anonymous": "AB",
"energy": -15.21808914,
"energy_per_atom": -7.60904457,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.21808914,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.5130612,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:37.008000Z",
"spacegroup": 225
},
{
"id": "mp-1052023",
"created_at": "2022-09-04T14:46:15.453961Z",
"structure_string": "Mg4 Cu2\n1.0\n-4.161777 3.219816 -0.271859\n0.015168 -6.419717 -0.009915\n-1.127862 3.219255 4.016100\nMg Cu\n4 2\ndirect\n0.913578 0.078985 0.080283 Mg\n0.252956 0.087631 0.419788 Mg\n0.412799 0.745986 0.579338 Mg\n0.753723 0.420584 0.920663 Mg\n0.333345 0.583343 0.000182 Cu\n0.833603 0.583469 0.499742 Cu\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Cu"
],
"chemical_system": "Cu-Mg",
"density": 3.418427668889785,
"density_atomic": 0.05506505030595009,
"volume": 108.96203611298012,
"volume_molar": 10.936411982809492,
"formula_full": "Mg4 Cu2",
"formula_reduced": "Mg2Cu",
"formula_anonymous": "AB2",
"energy": -15.21713377,
"energy_per_atom": -2.536188961666667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.21713377,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 2.5e-06,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:31.776000Z",
"spacegroup": 140
},
{
"id": "mp-1067758",
"created_at": "2022-09-04T14:39:46.874350Z",
"structure_string": "Bi4\n1.0\n4.577571 0.000000 0.000000\n0.000000 4.613294 0.000000\n0.000000 1.512012 6.642218\nBi\n4\ndirect\n0.250000 0.855686 0.214821 Bi\n0.750000 0.144314 0.785179 Bi\n0.250000 0.677167 0.682104 Bi\n0.750000 0.322833 0.317896 Bi\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Bi"
],
"chemical_system": "Bi",
"density": 9.895899999797473,
"density_atomic": 0.02851679045798503,
"volume": 140.26823971980178,
"volume_molar": 21.117877093751737,
"formula_full": "Bi4",
"formula_reduced": "Bi",
"formula_anonymous": "A",
"energy": -15.21669958,
"energy_per_atom": -3.804174895,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.21669958,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001712,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:38.940000Z",
"spacegroup": 11
},
{
"id": "mp-1186729",
"created_at": "2022-09-04T14:47:24.056347Z",
"structure_string": "Pr2 Mg1 In1\n1.0\n0.000000 3.905133 3.905133\n3.905133 0.000000 3.905133\n3.905133 3.905133 0.000000\nPr Mg In\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Pr\n0.750000 0.750000 0.750000 Pr\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pr",
"Mg",
"In"
],
"chemical_system": "In-Mg-Pr",
"density": 5.868539822255531,
"density_atomic": 0.03358323334084957,
"volume": 119.107054386408,
"volume_molar": 17.93198617559811,
"formula_full": "Pr2 Mg1 In1",
"formula_reduced": "Pr2MgIn",
"formula_anonymous": "ABC2",
"energy": -15.21667498,
"energy_per_atom": -3.804168745,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.21667498,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0450248,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:03.507000Z",
"spacegroup": 225
}
]
}