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=elements&page=34",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=elements&page=32",
"results": [
{
"id": "mp-672233",
"created_at": "2022-09-04T14:44:51.914297Z",
"structure_string": "N4\n1.0\n2.021595 -3.501506 0.000000\n2.021595 3.501506 0.000000\n0.000000 0.000000 6.670694\nN\n4\ndirect\n0.333333 0.666667 0.333512 N\n0.333333 0.666667 0.166488 N\n0.666667 0.333333 0.833512 N\n0.666667 0.333333 0.666488 N\n",
"nsites": 4,
"nelements": 1,
"elements": [
"N"
],
"chemical_system": "N",
"density": 0.9851330091447384,
"density_atomic": 0.04235551307904192,
"volume": 94.43870960872043,
"volume_molar": 14.218080061411973,
"formula_full": "N4",
"formula_reduced": "N",
"formula_anonymous": "A",
"energy": -33.29043379,
"energy_per_atom": -8.3226084475,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -33.29043379,
"band_gap": 6.5645,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:41.073000Z",
"spacegroup": 194
},
{
"id": "mp-154",
"created_at": "2022-09-04T14:46:29.994195Z",
"structure_string": "N8\n1.0\n5.872462 0.000000 0.000000\n0.000000 5.872462 0.000000\n0.000000 0.000000 5.872462\nN\n8\ndirect\n0.063953 0.063953 0.063953 N\n0.436047 0.936047 0.563953 N\n0.563953 0.436047 0.936047 N\n0.936047 0.563953 0.436047 N\n0.954523 0.954523 0.954523 N\n0.545477 0.045477 0.454523 N\n0.454523 0.545477 0.045477 N\n0.045477 0.454523 0.545477 N\n",
"nsites": 8,
"nelements": 1,
"elements": [
"N"
],
"chemical_system": "N",
"density": 0.9187857815935583,
"density_atomic": 0.03950293293177644,
"volume": 202.51660842035207,
"volume_molar": 15.244794026814517,
"formula_full": "N8",
"formula_reduced": "N",
"formula_anonymous": "A",
"energy": -66.69154488,
"energy_per_atom": -8.33644311,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -66.69154488,
"band_gap": 7.376399999999999,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 3.58e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:41.345000Z",
"spacegroup": 198
},
{
"id": "mp-1080711",
"created_at": "2022-09-04T14:39:32.791518Z",
"structure_string": "N10\n1.0\n-2.878553 2.878553 2.878553\n2.878553 -2.878553 2.878553\n2.878553 2.878553 -2.878553\nN\n10\ndirect\n0.000000 0.713409 0.713409 N\n0.286591 0.000000 0.286591 N\n0.286591 0.286591 0.000000 N\n0.000000 0.286591 0.286591 N\n0.713409 0.000000 0.713409 N\n0.713409 0.713409 0.000000 N\n0.271904 0.000000 0.000000 N\n0.000000 0.271904 0.000000 N\n0.000000 0.000000 0.271904 N\n0.728096 0.728096 0.728096 N\n",
"nsites": 10,
"nelements": 1,
"elements": [
"N"
],
"chemical_system": "N",
"density": 2.4378234073124623,
"density_atomic": 0.10481352289926871,
"volume": 95.40753638832008,
"volume_molar": 5.745576136952856,
"formula_full": "N10",
"formula_reduced": "N",
"formula_anonymous": "A",
"energy": -62.98561016,
"energy_per_atom": -6.298561016,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -62.98561016,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 5.4750054,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:33.754000Z",
"spacegroup": 217
},
{
"id": "mp-672234",
"created_at": "2022-09-04T14:43:59.913119Z",
"structure_string": "N4\n1.0\n5.577698 0.000000 0.000000\n0.000000 5.577698 0.000000\n0.000000 0.000000 5.577698\nN\n4\ndirect\n0.471208 0.971208 0.528792 N\n0.971208 0.528792 0.471208 N\n0.028792 0.028792 0.028792 N\n0.528792 0.471208 0.971208 N\n",
"nsites": 4,
"nelements": 1,
"elements": [
"N"
],
"chemical_system": "N",
"density": 0.5361421203459383,
"density_atomic": 0.02305127772568755,
"volume": 173.52617271807617,
"volume_molar": 26.12497594130816,
"formula_full": "N4",
"formula_reduced": "N",
"formula_anonymous": "A",
"energy": -12.49627799,
"energy_per_atom": -3.1240694975,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.49627799,
"band_gap": 2.9912,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 12.0000918,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:08.563000Z",
"spacegroup": 198
},
{
"id": "mp-721759",
"created_at": "2022-09-04T14:39:45.126233Z",
"structure_string": "N1\n1.0\n0.000000 1.537618 1.537618\n1.537618 0.000000 1.537618\n1.537618 1.537618 0.000000\nN\n1\ndirect\n0.000000 0.000000 0.000000 N\n",
"nsites": 1,
"nelements": 1,
"elements": [
"N"
],
"chemical_system": "N",
"density": 3.1989655675646826,
"density_atomic": 0.13753861324170039,
"volume": 7.270685492827185,
"volume_molar": 4.378509145949527,
"formula_full": "N1",
"formula_reduced": "N",
"formula_anonymous": "A",
"energy": -3.82991611,
"energy_per_atom": -3.82991611,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -3.82991611,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002661,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:25.212000Z",
"spacegroup": 225
},
{
"id": "mp-568584",
"created_at": "2022-09-04T14:45:07.625639Z",
"structure_string": "N16\n1.0\n5.075173 -4.719850 0.000000\n5.075173 4.719850 0.000000\n0.685769 0.000000 6.896672\nN\n16\ndirect\n0.045713 0.561851 0.724495 N\n0.275505 0.954287 0.438149 N\n0.561851 0.724495 0.045713 N\n0.956668 0.956668 0.956668 N\n0.061851 0.545713 0.224495 N\n0.454287 0.775505 0.938149 N\n0.438149 0.275505 0.954287 N\n0.043332 0.043332 0.043332 N\n0.938149 0.454287 0.775505 N\n0.543332 0.543332 0.543332 N\n0.954287 0.438149 0.275505 N\n0.456668 0.456668 0.456668 N\n0.724495 0.045713 0.561851 N\n0.775505 0.938149 0.454287 N\n0.545713 0.224495 0.061851 N\n0.224495 0.061851 0.545713 N\n",
"nsites": 16,
"nelements": 1,
"elements": [
"N"
],
"chemical_system": "N",
"density": 1.126305725992504,
"density_atomic": 0.04842519382199112,
"volume": 330.4065247279194,
"volume_molar": 12.435966249587196,
"formula_full": "N16",
"formula_reduced": "N",
"formula_anonymous": "A",
"energy": -133.12873838,
"energy_per_atom": -8.32054614875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -133.12873838,
"band_gap": 7.0262,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0115063,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:48.625000Z",
"spacegroup": 167
},
{
"id": "mp-754514",
"created_at": "2022-09-04T14:39:38.916775Z",
"structure_string": "N2\n1.0\n-1.083636 1.692473 3.886485\n1.083636 -1.692473 3.886485\n1.083636 1.692473 -3.886485\nN\n2\ndirect\n0.605821 0.250000 0.355821 N\n0.394179 0.750000 0.644179 N\n",
"nsites": 2,
"nelements": 1,
"elements": [
"N"
],
"chemical_system": "N",
"density": 1.6315213420227785,
"density_atomic": 0.07014679530510878,
"volume": 28.511637506757776,
"volume_molar": 8.58505471818954,
"formula_full": "N2",
"formula_reduced": "N",
"formula_anonymous": "A",
"energy": -14.59734601,
"energy_per_atom": -7.298673005,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -14.59734601,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 1.24e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:35.763000Z",
"spacegroup": 74
},
{
"id": "mp-570747",
"created_at": "2022-09-04T14:41:08.844775Z",
"structure_string": "N4\n1.0\n4.061881 0.000000 0.000000\n0.000000 4.061881 0.000000\n0.000000 0.000000 5.338196\nN\n4\ndirect\n0.903123 0.903123 0.000000 N\n0.596877 0.403123 0.500000 N\n0.096877 0.096877 0.000000 N\n0.403123 0.596877 0.500000 N\n",
"nsites": 4,
"nelements": 1,
"elements": [
"N"
],
"chemical_system": "N",
"density": 1.0563212303584673,
"density_atomic": 0.04541623036970457,
"volume": 88.074240584006,
"volume_molar": 13.259886853174718,
"formula_full": "N4",
"formula_reduced": "N",
"formula_anonymous": "A",
"energy": -33.31661044,
"energy_per_atom": -8.32915261,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -33.31661044,
"band_gap": 6.739,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001172,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:25.798000Z",
"spacegroup": 136
},
{
"id": "mp-1176403",
"created_at": "2022-09-04T14:41:59.911255Z",
"structure_string": "N4\n1.0\n2.174460 0.000000 0.000000\n0.000000 3.349316 0.000000\n0.000000 0.000000 7.727432\nN\n4\ndirect\n0.519546 0.856495 0.750000 N\n0.019546 0.643505 0.750000 N\n0.980454 0.356495 0.250000 N\n0.480454 0.143505 0.250000 N\n",
"nsites": 4,
"nelements": 1,
"elements": [
"N"
],
"chemical_system": "N",
"density": 1.6531116117352054,
"density_atomic": 0.07107506280066113,
"volume": 56.27852923912988,
"volume_molar": 8.472930621095397,
"formula_full": "N4",
"formula_reduced": "N",
"formula_anonymous": "A",
"energy": -29.19879891,
"energy_per_atom": -7.2996997275,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -29.19879891,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0071702,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:42.644000Z",
"spacegroup": 62
},
{
"id": "mp-1189505",
"created_at": "2022-09-04T14:44:27.822195Z",
"structure_string": "N16\n1.0\n0.000000 0.000000 -4.239789\n0.000000 -9.460163 0.000000\n-9.709648 0.000000 0.000000\nN\n16\ndirect\n0.000000 0.500000 0.500000 N\n0.000000 0.000000 0.000000 N\n0.000000 0.500000 0.000000 N\n0.000000 0.000000 0.500000 N\n0.000000 0.500000 0.377713 N\n0.000000 0.000000 0.122287 N\n0.000000 0.500000 0.622287 N\n0.000000 0.000000 0.877713 N\n0.888135 0.614897 0.000000 N\n0.111865 0.385103 0.000000 N\n0.888135 0.885103 0.500000 N\n0.111865 0.114897 0.500000 N\n0.466871 0.750000 0.250000 N\n0.533129 0.250000 0.250000 N\n0.533129 0.250000 0.750000 N\n0.466871 0.750000 0.750000 N\n",
"nsites": 16,
"nelements": 1,
"elements": [
"N"
],
"chemical_system": "N",
"density": 0.955561311721699,
"density_atomic": 0.04108408637285692,
"volume": 389.4451942971949,
"volume_molar": 14.658086114770356,
"formula_full": "N16",
"formula_reduced": "N",
"formula_anonymous": "A",
"energy": -98.54534138,
"energy_per_atom": -6.15908383625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -98.54534138,
"band_gap": 0.2718000000000002,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 8.0003203,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:33.452000Z",
"spacegroup": 53
},
{
"id": "mp-999498",
"created_at": "2022-09-04T14:46:24.608362Z",
"structure_string": "N4\n1.0\n-1.902148 1.902148 1.902148\n1.902148 -1.902148 1.902148\n1.902148 1.902148 -1.902148\nN\n4\ndirect\n0.328702 0.328702 0.328702 N\n0.500000 0.000000 0.171298 N\n0.000000 0.171298 0.500000 N\n0.171298 0.500000 0.000000 N\n",
"nsites": 4,
"nelements": 1,
"elements": [
"N"
],
"chemical_system": "N",
"density": 3.379496565757236,
"density_atomic": 0.14530049207850398,
"volume": 27.529156596653863,
"volume_molar": 4.144611400728302,
"formula_full": "N4",
"formula_reduced": "N",
"formula_anonymous": "A",
"energy": -27.37226736,
"energy_per_atom": -6.84306684,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -27.37226736,
"band_gap": 3.9594,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002313,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:35.472000Z",
"spacegroup": 199
},
{
"id": "mp-25",
"created_at": "2022-09-04T14:41:34.480996Z",
"structure_string": "N8\n1.0\n5.855921 0.000000 0.000000\n0.000000 5.855921 0.000000\n0.000000 0.000000 5.855921\nN\n8\ndirect\n0.054869 0.054869 0.054869 N\n0.445131 0.945131 0.554869 N\n0.554869 0.445131 0.945131 N\n0.945131 0.554869 0.445131 N\n0.945131 0.945131 0.945131 N\n0.554869 0.054869 0.445131 N\n0.445131 0.554869 0.054869 N\n0.054869 0.445131 0.554869 N\n",
"nsites": 8,
"nelements": 1,
"elements": [
"N"
],
"chemical_system": "N",
"density": 0.926593573513627,
"density_atomic": 0.03983862672106081,
"volume": 200.81013474720945,
"volume_molar": 15.116336218528279,
"formula_full": "N8",
"formula_reduced": "N",
"formula_anonymous": "A",
"energy": -66.6919594,
"energy_per_atom": -8.336494925,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -66.6919594,
"band_gap": 7.3685,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 3.13e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:28.430000Z",
"spacegroup": 205
}
]
}