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=formula_anonymous&page=9",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=formula_anonymous&page=7",
"results": [
{
"id": "mp-680372",
"created_at": "2022-09-04T14:41:17.125517Z",
"structure_string": "C60\n1.0\n8.650536 -4.602332 0.000000\n8.650536 4.602332 0.000000\n6.201965 0.000000 7.586097\nC\n60\ndirect\n0.027412 0.874754 0.716891 C\n0.249245 0.249245 0.572032 C\n0.716891 0.027412 0.874754 C\n0.916965 0.471829 0.645118 C\n0.027412 0.716891 0.874754 C\n0.083035 0.528171 0.354882 C\n0.572032 0.249245 0.249245 C\n0.645118 0.916965 0.471829 C\n0.631259 0.888942 0.196324 C\n0.249245 0.572032 0.249245 C\n0.888942 0.196324 0.631259 C\n0.945185 0.791196 0.455044 C\n0.736983 0.736983 0.305958 C\n0.736983 0.305958 0.736983 C\n0.471829 0.645118 0.916965 C\n0.528171 0.083035 0.354882 C\n0.283109 0.972588 0.125246 C\n0.054815 0.544956 0.208804 C\n0.054815 0.208804 0.544956 C\n0.125246 0.972588 0.283109 C\n0.083035 0.354882 0.528171 C\n0.455044 0.945185 0.791196 C\n0.945185 0.455044 0.791196 C\n0.305958 0.736983 0.736983 C\n0.916965 0.645118 0.471829 C\n0.972588 0.125246 0.283109 C\n0.196324 0.631259 0.888942 C\n0.125246 0.283109 0.972588 C\n0.631259 0.196324 0.888942 C\n0.263017 0.694042 0.263017 C\n0.427968 0.750755 0.750755 C\n0.874754 0.027412 0.716891 C\n0.471829 0.916965 0.645118 C\n0.354882 0.528171 0.083035 C\n0.208804 0.054815 0.544956 C\n0.750755 0.427968 0.750755 C\n0.750755 0.750755 0.427968 C\n0.791196 0.455044 0.945185 C\n0.716891 0.874754 0.027412 C\n0.694042 0.263017 0.263017 C\n0.544956 0.054815 0.208804 C\n0.791196 0.945185 0.455044 C\n0.528171 0.354882 0.083035 C\n0.263017 0.263017 0.694042 C\n0.645118 0.471829 0.916965 C\n0.111058 0.803676 0.368741 C\n0.354882 0.083035 0.528171 C\n0.196324 0.888942 0.631259 C\n0.972588 0.283109 0.125246 C\n0.544956 0.208804 0.054815 C\n0.803676 0.111058 0.368741 C\n0.888942 0.631259 0.196324 C\n0.111058 0.368741 0.803676 C\n0.283109 0.125246 0.972588 C\n0.368741 0.803676 0.111058 C\n0.455044 0.791196 0.945185 C\n0.874754 0.716891 0.027412 C\n0.208804 0.544956 0.054815 C\n0.368741 0.111058 0.803676 C\n0.803676 0.368741 0.111058 C\n",
"nsites": 60,
"nelements": 1,
"elements": [
"C"
],
"chemical_system": "C",
"density": 1.9810677035606912,
"density_atomic": 0.09933033520157261,
"volume": 604.0450772489698,
"volume_molar": 6.06274080096395,
"formula_full": "C60",
"formula_reduced": "C",
"formula_anonymous": "A",
"energy": -529.17093066,
"energy_per_atom": -8.819515510999999,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -529.17093066,
"band_gap": 0.7132000000000001,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002577,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:18.689000Z",
"spacegroup": 166
},
{
"id": "mp-104",
"created_at": "2022-09-04T14:41:55.784372Z",
"structure_string": "Sb2\n1.0\n4.060155 -2.192977 0.000000\n4.060155 2.192977 0.000000\n2.875681 0.000000 3.608942\nSb\n2\ndirect\n0.731830 0.731830 0.731830 Sb\n0.268170 0.268170 0.268170 Sb\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Sb"
],
"chemical_system": "Sb",
"density": 6.292122136443163,
"density_atomic": 0.03112027365133651,
"volume": 64.26678706002018,
"volume_molar": 19.351181893419405,
"formula_full": "Sb2",
"formula_reduced": "Sb",
"formula_anonymous": "A",
"energy": -8.25800248,
"energy_per_atom": -4.12900124,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.25800248,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0009531,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:33.169000Z",
"spacegroup": 166
},
{
"id": "mp-974620",
"created_at": "2022-09-04T14:41:56.812325Z",
"structure_string": "Rb8\n1.0\n9.004761 0.000000 0.000000\n0.000000 9.004761 0.000000\n0.000000 0.000000 9.004761\nRb\n8\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.250000 0.000000 Rb\n0.500000 0.750000 0.000000 Rb\n0.000000 0.500000 0.250000 Rb\n0.250000 0.000000 0.500000 Rb\n0.750000 0.000000 0.500000 Rb\n0.500000 0.500000 0.500000 Rb\n0.000000 0.500000 0.750000 Rb\n",
"nsites": 8,
"nelements": 1,
"elements": [
"Rb"
],
"chemical_system": "Rb",
"density": 1.5549808254789264,
"density_atomic": 0.010956539671515114,
"volume": 730.1575351201852,
"volume_molar": 54.96389316835499,
"formula_full": "Rb8",
"formula_reduced": "Rb",
"formula_anonymous": "A",
"energy": -7.55309927,
"energy_per_atom": -0.94413740875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -7.55309927,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.8378747,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:30.669000Z",
"spacegroup": 223
},
{
"id": "mp-8632",
"created_at": "2022-09-04T14:42:47.362829Z",
"structure_string": "V1\n1.0\n0.000000 1.909544 1.909544\n1.909544 0.000000 1.909544\n1.909544 1.909544 0.000000\nV\n1\ndirect\n0.000000 0.000000 0.000000 V\n",
"nsites": 1,
"nelements": 1,
"elements": [
"V"
],
"chemical_system": "V",
"density": 6.0743780976875925,
"density_atomic": 0.07180934983535475,
"volume": 13.92576318115692,
"volume_molar": 8.386290606735237,
"formula_full": "V1",
"formula_reduced": "V",
"formula_anonymous": "A",
"energy": -8.83676567,
"energy_per_atom": -8.83676567,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.83676567,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0020693,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:12.043000Z",
"spacegroup": 225
},
{
"id": "mp-867200",
"created_at": "2022-09-04T14:41:27.638568Z",
"structure_string": "Pm4\n1.0\n1.837611 -3.182835 0.000000\n1.837611 3.182835 0.000000\n0.000000 0.000000 11.825740\nPm\n4\ndirect\n0.000000 0.000000 0.000000 Pm\n0.333333 0.666667 0.250000 Pm\n0.000000 0.000000 0.500000 Pm\n0.666667 0.333333 0.750000 Pm\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Pm"
],
"chemical_system": "Pm",
"density": 6.962273214756299,
"density_atomic": 0.028915716774709995,
"volume": 138.33307440258386,
"volume_molar": 20.826531145397823,
"formula_full": "Pm4",
"formula_reduced": "Pm",
"formula_anonymous": "A",
"energy": -19.00216929,
"energy_per_atom": -4.7505423225,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -19.00216929,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0148421,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:30.719000Z",
"spacegroup": 194
},
{
"id": "mp-1055423",
"created_at": "2022-09-04T14:42:49.865549Z",
"structure_string": "Pu4\n1.0\n-0.018661 0.198357 3.522173\n4.535293 -0.273562 -0.014382\n1.969982 4.375312 0.246116\nPu\n4\ndirect\n0.857106 0.340361 0.247748 Pu\n0.581779 0.841192 0.251814 Pu\n0.418545 0.158791 0.748301 Pu\n0.142573 0.659657 0.752137 Pu\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Pu"
],
"chemical_system": "Pu",
"density": 22.647044571012607,
"density_atomic": 0.05589495502121435,
"volume": 71.56280917449243,
"volume_molar": 10.774032750745322,
"formula_full": "Pu4",
"formula_reduced": "Pu",
"formula_anonymous": "A",
"energy": -56.71455862,
"energy_per_atom": -14.178639655,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -56.71455862,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0014306,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:55.550000Z",
"spacegroup": 2
},
{
"id": "mp-23157",
"created_at": "2022-09-04T14:42:16.611104Z",
"structure_string": "Bi2\n1.0\n3.132578 3.488598 0.000000\n-3.132578 3.488598 0.000000\n0.000000 1.260235 3.113550\nBi\n2\ndirect\n0.753061 0.753061 0.142618 Bi\n0.246939 0.246939 0.857382 Bi\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Bi"
],
"chemical_system": "Bi",
"density": 10.198727503087682,
"density_atomic": 0.029389441602036444,
"volume": 68.05165021785976,
"volume_molar": 20.490830828111807,
"formula_full": "Bi2",
"formula_reduced": "Bi",
"formula_anonymous": "A",
"energy": -7.67946817,
"energy_per_atom": -3.839734085,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -7.67946817,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0003114,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:40.233000Z",
"spacegroup": 12
},
{
"id": "mp-1403870",
"created_at": "2022-09-04T14:43:09.375894Z",
"structure_string": "Si8\n1.0\n-3.974623 0.000000 0.000000\n1.976217 5.084593 0.000000\n-0.110606 -2.650884 -8.615209\nSi\n8\ndirect\n0.094740 0.827655 0.917667 Si\n0.000724 0.211002 0.940289 Si\n0.566595 0.003634 0.759282 Si\n0.125707 0.361705 0.371541 Si\n0.841008 0.069501 0.198355 Si\n0.286715 0.842253 0.317670 Si\n0.567874 0.132669 0.488678 Si\n0.509253 0.566418 0.999908 Si\n",
"nsites": 8,
"nelements": 1,
"elements": [
"Si"
],
"chemical_system": "Si",
"density": 2.142906835476681,
"density_atomic": 0.04594857347480511,
"volume": 174.1076902939462,
"volume_molar": 13.106262729357873,
"formula_full": "Si8",
"formula_reduced": "Si",
"formula_anonymous": "A",
"energy": -33.39652816,
"energy_per_atom": -4.17456602,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -33.39652816,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 6e-07,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:03.232000Z",
"spacegroup": 1
},
{
"id": "mp-1178801",
"created_at": "2022-09-04T14:42:07.885470Z",
"structure_string": "W20\n1.0\n2.628867 0.000000 0.000000\n0.000000 9.433227 0.000000\n0.000000 2.672918 14.754390\nW\n20\ndirect\n0.500000 0.644155 0.976633 W\n0.500000 0.355845 0.023367 W\n0.500000 0.936229 0.928019 W\n0.500000 0.063771 0.071981 W\n0.500000 0.226823 0.876616 W\n0.500000 0.773177 0.123384 W\n0.500000 0.516649 0.828896 W\n0.500000 0.483351 0.171104 W\n0.500000 0.804473 0.782536 W\n0.500000 0.195527 0.217464 W\n0.500000 0.095223 0.734057 W\n0.500000 0.904777 0.265943 W\n0.500000 0.387918 0.682405 W\n0.500000 0.612082 0.317595 W\n0.500000 0.674230 0.635727 W\n0.500000 0.325770 0.364273 W\n0.500000 0.960867 0.589879 W\n0.500000 0.039133 0.410121 W\n0.500000 0.248933 0.543223 W\n0.500000 0.751067 0.456777 W\n",
"nsites": 20,
"nelements": 1,
"elements": [
"W"
],
"chemical_system": "W",
"density": 16.68664187933335,
"density_atomic": 0.05466128494548702,
"volume": 365.8896789555119,
"volume_molar": 11.017195746506513,
"formula_full": "W20",
"formula_reduced": "W",
"formula_anonymous": "A",
"energy": -235.19982047,
"energy_per_atom": -11.7599910235,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -235.19982047,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0004446,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:45.279000Z",
"spacegroup": 10
},
{
"id": "mp-1057818",
"created_at": "2022-09-04T14:42:24.625342Z",
"structure_string": "O2\n1.0\n0.000000 2.142855 2.142855\n2.142855 0.000000 2.142855\n2.142855 2.142855 0.000000\nO\n2\ndirect\n0.250000 0.250000 0.250000 O\n0.000000 0.000000 0.000000 O\n",
"nsites": 2,
"nelements": 1,
"elements": [
"O"
],
"chemical_system": "O",
"density": 2.7000663693942357,
"density_atomic": 0.1016299345191283,
"volume": 19.679241253703353,
"volume_molar": 5.925558043990024,
"formula_full": "O2",
"formula_reduced": "O",
"formula_anonymous": "A",
"energy": -6.13423966,
"energy_per_atom": -3.06711983,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -6.13423966,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0008017,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:50.200000Z",
"spacegroup": 227
},
{
"id": "mp-972981",
"created_at": "2022-09-04T14:42:04.406659Z",
"structure_string": "K2\n1.0\n2.387715 -4.017190 0.000000\n2.387715 4.017190 0.000000\n0.000000 0.000000 7.650362\nK\n2\ndirect\n0.820386 0.179614 0.250000 K\n0.179614 0.820386 0.750000 K\n",
"nsites": 2,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.8847490924390605,
"density_atomic": 0.013627404705042282,
"volume": 146.7630882980953,
"volume_molar": 44.19139880517194,
"formula_full": "K2",
"formula_reduced": "K",
"formula_anonymous": "A",
"energy": -2.20404441,
"energy_per_atom": -1.102022205,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -2.20404441,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001087,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:37.695000Z",
"spacegroup": 63
},
{
"id": "mp-135",
"created_at": "2022-09-04T14:45:03.944801Z",
"structure_string": "Li1\n1.0\n-1.713409 1.713409 1.713409\n1.713409 -1.713409 1.713409\n1.713409 1.713409 -1.713409\nLi\n1\ndirect\n0.000000 0.000000 0.000000 Li\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Li"
],
"chemical_system": "Li",
"density": 0.5728329870110183,
"density_atomic": 0.04970005591332286,
"volume": 20.120701709953906,
"volume_molar": 12.116969788731513,
"formula_full": "Li1",
"formula_reduced": "Li",
"formula_anonymous": "A",
"energy": -1.90379596,
"energy_per_atom": -1.90379596,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -1.90379596,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001077,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:52.373000Z",
"spacegroup": 229
}
]
}