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=41",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-formula_anonymous&page=39",
"results": [
{
"id": "mp-1522826",
"created_at": "2022-09-04T14:47:56.945684Z",
"structure_string": "Sr1 Eu1 Dy1 Sb1 O6\n1.0\n0.000000 -4.195909 -4.195909\n4.195909 -0.000000 -4.195909\n4.195909 -4.195909 -0.000000\nSr Eu Dy Sb O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Sr\n0.250000 0.250000 0.250000 Eu\n0.000000 0.000000 0.000000 Dy\n0.500000 0.500000 0.500000 Sb\n0.737405 0.262595 0.262595 O\n0.262595 0.737405 0.737405 O\n0.737405 0.262595 0.737405 O\n0.262595 0.737405 0.262595 O\n0.737405 0.737405 0.262595 O\n0.262595 0.262595 0.737405 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Sr",
"Eu",
"Dy",
"Sb",
"O"
],
"chemical_system": "Dy-Eu-O-Sb-Sr",
"density": 6.966598772084006,
"density_atomic": 0.0676849047568235,
"volume": 147.743430177345,
"volume_molar": 8.897317328932035,
"formula_full": "Sr1 Eu1 Dy1 Sb1 O6",
"formula_reduced": "SrEuDySbO6",
"formula_anonymous": "ABCDE6",
"energy": -80.6707815,
"energy_per_atom": -8.06707815,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -76.5487815,
"band_gap": 0.2673999999999994,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 7.0000002,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:17.914000Z",
"spacegroup": 216
},
{
"id": "mp-1522722",
"created_at": "2022-09-04T14:47:18.515350Z",
"structure_string": "Ca1 Hf1 Ti1 Sn1 O6\n1.0\n0.000000 -4.019681 -4.019681\n4.019681 0.000000 -4.019681\n4.019681 -4.019681 0.000000\nCa Hf Ti Sn O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ca\n0.000000 0.000000 0.000000 Hf\n0.500000 0.500000 0.500000 Ti\n0.750000 0.750000 0.750000 Sn\n0.743675 0.256325 0.256325 O\n0.256325 0.743675 0.743675 O\n0.743675 0.256325 0.743675 O\n0.256325 0.743675 0.256325 O\n0.743675 0.743675 0.256325 O\n0.256325 0.256325 0.743675 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Ca",
"Hf",
"Ti",
"Sn",
"O"
],
"chemical_system": "Ca-Hf-O-Sn-Ti",
"density": 6.150594027930138,
"density_atomic": 0.07698307193396953,
"volume": 129.89868744881045,
"volume_molar": 7.822681803559819,
"formula_full": "Ca1 Hf1 Ti1 Sn1 O6",
"formula_reduced": "CaHfTiSnO6",
"formula_anonymous": "ABCDE6",
"energy": -85.01507096,
"energy_per_atom": -8.501507096000001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -80.89307096,
"band_gap": 2.3192000000000004,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:06.259000Z",
"spacegroup": 216
},
{
"id": "mp-1521109",
"created_at": "2022-09-04T14:48:30.667675Z",
"structure_string": "Sr2 Ca2 Y2 Bi2 O12\n1.0\n5.863999 0.000071 0.007336\n0.004247 6.038070 -0.000213\n0.017488 0.005139 8.417659\nSr Ca Y Bi O\n2 2 2 2 12\ndirect\n0.510734 0.549825 0.250066 Sr\n0.489266 0.450175 0.749934 Sr\n0.985932 0.048773 0.248528 Ca\n0.014068 0.951227 0.751472 Ca\n0.500000 0.000000 -0.000000 Y\n0.000000 0.500000 0.500000 Y\n0.000000 0.500000 -0.000000 Bi\n0.500000 0.000000 0.500000 Bi\n0.186128 0.203854 0.937333 O\n0.309713 0.707608 0.553954 O\n0.813872 0.796146 0.062667 O\n0.690287 0.292392 0.446046 O\n0.294212 0.695988 0.949787 O\n0.204580 0.191637 0.563501 O\n0.705788 0.304012 0.050213 O\n0.795420 0.808363 0.436499 O\n0.380685 0.966291 0.258182 O\n0.098191 0.441564 0.242326 O\n0.619315 0.033709 0.741818 O\n0.901809 0.558436 0.757674 O\n",
"nsites": 20,
"nelements": 5,
"elements": [
"Sr",
"Ca",
"Y",
"Bi",
"O"
],
"chemical_system": "Bi-Ca-O-Sr-Y",
"density": 5.81190260239099,
"density_atomic": 0.06710389959271713,
"volume": 298.0452719050418,
"volume_molar": 8.974352901323174,
"formula_full": "Sr2 Ca2 Y2 Bi2 O12",
"formula_reduced": "SrCaYBiO6",
"formula_anonymous": "ABCDE6",
"energy": -144.32415553,
"energy_per_atom": -7.216207776500001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -136.08015553,
"band_gap": 1.8269,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:39:51.381000Z",
"spacegroup": 2
},
{
"id": "mp-1517671",
"created_at": "2022-09-04T14:47:23.750714Z",
"structure_string": "La1 Mg1 Fe1 Sn1 O6\n1.0\n-0.000000 -3.990470 -3.990470\n3.990470 -0.000000 -3.990470\n3.990470 -3.990470 0.000000\nLa Mg Fe Sn O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 La\n0.250000 0.250000 0.250000 Mg\n0.000000 0.000000 0.000000 Fe\n0.500000 0.500000 0.500000 Sn\n0.753395 0.246605 0.246605 O\n0.246605 0.753395 0.753395 O\n0.753395 0.246605 0.753395 O\n0.246605 0.753395 0.246605 O\n0.753395 0.753395 0.246605 O\n0.246605 0.246605 0.753395 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"La",
"Mg",
"Fe",
"Sn",
"O"
],
"chemical_system": "Fe-La-Mg-O-Sn",
"density": 5.667588675174762,
"density_atomic": 0.07868606980940783,
"volume": 127.08729797055366,
"volume_molar": 7.653375971867365,
"formula_full": "La1 Mg1 Fe1 Sn1 O6",
"formula_reduced": "LaMgFeSnO6",
"formula_anonymous": "ABCDE6",
"energy": -71.78252899,
"energy_per_atom": -7.178252899,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -65.40452899,
"band_gap": 1.1086,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 5.0000008,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:03.910000Z",
"spacegroup": 216
},
{
"id": "mp-1521024",
"created_at": "2022-09-04T14:40:04.884662Z",
"structure_string": "Ba1 Ca1 Eu1 W1 O6\n1.0\n-0.000000 -4.221198 -4.221198\n4.221198 0.000000 -4.221198\n4.221198 -4.221198 -0.000000\nBa Ca Eu W O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Ba\n0.000000 -0.000000 -0.000000 Ca\n0.250000 0.250000 0.250000 Eu\n0.500000 0.500000 0.500000 W\n0.731369 0.268631 0.268631 O\n0.268631 0.731369 0.731369 O\n0.731369 0.268631 0.731369 O\n0.268631 0.731369 0.268631 O\n0.731369 0.731369 0.268631 O\n0.268631 0.268631 0.731369 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Ba",
"Ca",
"Eu",
"W",
"O"
],
"chemical_system": "Ba-Ca-Eu-O-W",
"density": 6.7247427436668055,
"density_atomic": 0.06647568683919268,
"volume": 150.43093912200405,
"volume_molar": 9.059162900516991,
"formula_full": "Ba1 Ca1 Eu1 W1 O6",
"formula_reduced": "BaCaEuWO6",
"formula_anonymous": "ABCDE6",
"energy": -86.52273082,
"energy_per_atom": -8.652273082,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -77.96273082,
"band_gap": 0.5857999999999999,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.0000002,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:46.697000Z",
"spacegroup": 216
},
{
"id": "mp-1516941",
"created_at": "2022-09-04T14:47:08.869931Z",
"structure_string": "Sr1 Ca1 Eu1 W1 O6\n1.0\n-0.000000 -4.184089 -4.184089\n4.184089 -0.000000 -4.184089\n4.184089 -4.184089 -0.000000\nSr Ca Eu W O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n-0.000000 -0.000000 0.000000 Ca\n0.750000 0.750000 0.750000 Eu\n0.500000 0.500000 0.500000 W\n0.732403 0.267597 0.267597 O\n0.267597 0.732403 0.732403 O\n0.732403 0.267597 0.732403 O\n0.267597 0.732403 0.267597 O\n0.732403 0.732403 0.267597 O\n0.267597 0.267597 0.732403 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Sr",
"Ca",
"Eu",
"W",
"O"
],
"chemical_system": "Ca-Eu-O-Sr-W",
"density": 6.341838952046017,
"density_atomic": 0.06826015384435442,
"volume": 146.49835133395422,
"volume_molar": 8.82233692841006,
"formula_full": "Sr1 Ca1 Eu1 W1 O6",
"formula_reduced": "SrCaEuWO6",
"formula_anonymous": "ABCDE6",
"energy": -86.06919381,
"energy_per_atom": -8.606919381,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -77.50919381,
"band_gap": 0.5645999999999995,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.0000013,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:58.320000Z",
"spacegroup": 216
},
{
"id": "mp-1516633",
"created_at": "2022-09-04T14:40:09.935627Z",
"structure_string": "Na2 Ca2 Ce2 Bi2 O12\n1.0\n5.896131 0.000000 -0.000000\n0.000000 5.896131 -0.000000\n-0.000000 0.000000 8.642163\nNa Ca Ce Bi O\n2 2 2 2 12\ndirect\n0.500000 -0.000000 0.250000 Na\n0.000000 0.500000 0.750000 Na\n0.000000 0.500000 0.250000 Ca\n0.500000 -0.000000 0.750000 Ca\n0.000000 -0.000000 0.500000 Ce\n0.500000 0.500000 -0.000000 Ce\n0.000000 -0.000000 0.000000 Bi\n0.500000 0.500000 0.500000 Bi\n0.000000 -0.000000 0.245330 O\n0.500000 0.500000 0.254670 O\n0.000000 -0.000000 0.754670 O\n0.500000 0.500000 0.745330 O\n0.321310 0.166400 0.983488 O\n0.678690 0.833600 0.983488 O\n0.833600 0.321310 0.016512 O\n0.166400 0.678690 0.016512 O\n0.821310 0.333600 0.483488 O\n0.178690 0.666400 0.483488 O\n0.333600 0.178690 0.516512 O\n0.666400 0.821310 0.516512 O\n",
"nsites": 20,
"nelements": 5,
"elements": [
"Na",
"Ca",
"Ce",
"Bi",
"O"
],
"chemical_system": "Bi-Ca-Ce-Na-O",
"density": 5.617244848003391,
"density_atomic": 0.06656919331163616,
"volume": 300.4392723578947,
"volume_molar": 9.046437939856094,
"formula_full": "Na2 Ca2 Ce2 Bi2 O12",
"formula_reduced": "NaCaCeBiO6",
"formula_anonymous": "ABCDE6",
"energy": -136.49379485,
"energy_per_atom": -6.8246897425,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -128.24979485,
"band_gap": 1.541,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:47.040000Z",
"spacegroup": 118
},
{
"id": "mp-1049203",
"created_at": "2022-09-04T14:40:05.034106Z",
"structure_string": "La2 Mg2 Cr2 Bi2 O12\n1.0\n5.760341 0.000000 0.000000\n0.000000 5.558809 0.000000\n0.000000 5.424050 8.121621\nLa Mg Cr Bi O\n2 2 2 2 12\ndirect\n0.306288 0.765093 0.247615 La\n0.693712 0.765093 0.747615 La\n0.799718 0.230264 0.250642 Mg\n0.200282 0.230264 0.750642 Mg\n0.244200 0.000776 0.499549 Cr\n0.755800 0.000776 0.999549 Cr\n0.245257 0.500076 0.998123 Bi\n0.754743 0.500076 0.498123 Bi\n0.833636 0.344781 0.765720 O\n0.031297 0.112263 0.073843 O\n0.055683 0.786755 0.430643 O\n0.583186 0.227363 0.073790 O\n0.554315 0.916518 0.429830 O\n0.296228 0.616110 0.730245 O\n0.166364 0.344781 0.265720 O\n0.968703 0.112263 0.573843 O\n0.944317 0.786755 0.930643 O\n0.416814 0.227363 0.573790 O\n0.445685 0.916518 0.929830 O\n0.703772 0.616110 0.230245 O\n",
"nsites": 20,
"nelements": 5,
"elements": [
"La",
"Mg",
"Cr",
"Bi",
"O"
],
"chemical_system": "Bi-Cr-La-Mg-O",
"density": 6.642979198506607,
"density_atomic": 0.07690548779555108,
"volume": 260.05946484818975,
"volume_molar": 7.830573516430352,
"formula_full": "La2 Mg2 Cr2 Bi2 O12",
"formula_reduced": "LaMgCrBiO6",
"formula_anonymous": "ABCDE6",
"energy": -149.44274217999998,
"energy_per_atom": -7.472137108999999,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -137.20074218,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 4.0127,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:46.707000Z",
"spacegroup": 7
},
{
"id": "mp-1516194",
"created_at": "2022-09-04T14:41:37.270017Z",
"structure_string": "K1 La1 Co1 W1 O6\n1.0\n0.000000 -3.994311 -3.994311\n3.994311 0.000000 -3.994311\n3.994311 -3.994311 0.000000\nK La Co W O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 La\n0.000000 0.000000 0.000000 Co\n0.500000 0.500000 0.500000 W\n0.743443 0.256557 0.256557 O\n0.256557 0.743443 0.743443 O\n0.743443 0.256557 0.743443 O\n0.256557 0.743443 0.256557 O\n0.743443 0.743443 0.256557 O\n0.256557 0.256557 0.743443 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"K",
"La",
"Co",
"W",
"O"
],
"chemical_system": "Co-K-La-O-W",
"density": 6.732767143122218,
"density_atomic": 0.07845929028133403,
"volume": 127.45463238505822,
"volume_molar": 7.675497367368751,
"formula_full": "K1 La1 Co1 W1 O6",
"formula_reduced": "KLaCoWO6",
"formula_anonymous": "ABCDE6",
"energy": -79.34724746,
"energy_per_atom": -7.9347247460000006,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -69.14924746,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 3.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:25.648000Z",
"spacegroup": 216
},
{
"id": "mp-1519892",
"created_at": "2022-09-04T14:41:37.202985Z",
"structure_string": "Ca1 Eu1 Zr1 Sn1 O6\n1.0\n0.000000 -4.129084 -4.129084\n4.129084 0.000000 -4.129084\n4.129084 -4.129084 0.000000\nCa Eu Zr Sn O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Ca\n0.250000 0.250000 0.250000 Eu\n0.500000 0.500000 0.500000 Zr\n-0.000000 0.000000 -0.000000 Sn\n0.751393 0.248607 0.248607 O\n0.248607 0.751393 0.751393 O\n0.751393 0.248607 0.751393 O\n0.248607 0.751393 0.248607 O\n0.751393 0.751393 0.248607 O\n0.248607 0.248607 0.751393 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Ca",
"Eu",
"Zr",
"Sn",
"O"
],
"chemical_system": "Ca-Eu-O-Sn-Zr",
"density": 5.873043539363332,
"density_atomic": 0.07102460878530037,
"volume": 140.79627006787052,
"volume_molar": 8.47894956831691,
"formula_full": "Ca1 Eu1 Zr1 Sn1 O6",
"formula_reduced": "CaEuZrSnO6",
"formula_anonymous": "ABCDE6",
"energy": -84.85741517,
"energy_per_atom": -8.485741517,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -80.73541516999998,
"band_gap": 0.375,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 6.9999998,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:29.286000Z",
"spacegroup": 216
},
{
"id": "mp-1519602",
"created_at": "2022-09-04T14:42:12.246132Z",
"structure_string": "Eu1 Nb1 In1 Sn1 O6\n1.0\n-0.000000 -4.056994 -4.056994\n4.056994 -0.000000 -4.056994\n4.056994 -4.056994 -0.000000\nEu Nb In Sn O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Eu\n0.500000 0.500000 0.500000 Nb\n-0.000000 -0.000000 -0.000000 In\n0.250000 0.250000 0.250000 Sn\n0.742353 0.257647 0.257647 O\n0.257647 0.742353 0.742353 O\n0.742353 0.257647 0.742353 O\n0.257647 0.742353 0.257647 O\n0.742353 0.742353 0.257647 O\n0.257647 0.257647 0.742353 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Eu",
"Nb",
"In",
"Sn",
"O"
],
"chemical_system": "Eu-In-Nb-O-Sn",
"density": 7.141944813200196,
"density_atomic": 0.07487846073410825,
"volume": 133.54975385391236,
"volume_molar": 8.042554161716128,
"formula_full": "Eu1 Nb1 In1 Sn1 O6",
"formula_reduced": "EuNbInSnO6",
"formula_anonymous": "ABCDE6",
"energy": -80.96832072,
"energy_per_atom": -8.096832072,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -76.84632072,
"band_gap": 0.0648999999999997,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.0028419,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:37.525000Z",
"spacegroup": 216
},
{
"id": "mp-1520006",
"created_at": "2022-09-04T14:42:02.639657Z",
"structure_string": "Sr1 Ca1 Ce1 Ge1 O6\n1.0\n0.000000 -4.104287 -4.104287\n4.104287 0.000000 -4.104287\n4.104287 -4.104287 -0.000000\nSr Ca Ce Ge O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750000 Ca\n-0.000000 0.000000 0.000000 Ce\n0.500000 0.500000 0.500000 Ge\n0.732525 0.267475 0.267475 O\n0.267475 0.732525 0.732525 O\n0.732525 0.267475 0.732525 O\n0.267475 0.732525 0.267475 O\n0.732525 0.732525 0.267475 O\n0.267475 0.267475 0.732525 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Sr",
"Ca",
"Ce",
"Ge",
"O"
],
"chemical_system": "Ca-Ce-Ge-O-Sr",
"density": 5.241321882033122,
"density_atomic": 0.07231973702619911,
"volume": 138.27483908545358,
"volume_molar": 8.327105445389511,
"formula_full": "Sr1 Ca1 Ce1 Ge1 O6",
"formula_reduced": "SrCaCeGeO6",
"formula_anonymous": "ABCDE6",
"energy": -74.38683806,
"energy_per_atom": -7.438683806,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -70.26483806,
"band_gap": 2.0936000000000003,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:45.357000Z",
"spacegroup": 216
}
]
}