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&page=12168",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=density&page=12166",
"results": [
{
"id": "mp-1070103",
"created_at": "2022-09-04T14:41:45.328660Z",
"structure_string": "Hf2 Pt3\n1.0\n-1.741959 1.741959 7.378610\n1.741959 -1.741959 7.378610\n1.741959 1.741959 -7.378610\nHf Pt\n2 3\ndirect\n0.889150 0.889150 0.000000 Hf\n0.110850 0.110850 0.000000 Hf\n0.500000 0.500000 0.000000 Pt\n0.305345 0.305345 0.000000 Pt\n0.694655 0.694655 0.000000 Pt\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Hf",
"Pt"
],
"chemical_system": "Hf-Pt",
"density": 17.47014629598138,
"density_atomic": 0.055828967880813866,
"volume": 89.55924119310642,
"volume_molar": 10.786767136473541,
"formula_full": "Hf2 Pt3",
"formula_reduced": "Hf2Pt3",
"formula_anonymous": "A2B3",
"energy": -43.7072027,
"energy_per_atom": -8.741440540000001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -43.7072027,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0006051,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:23.267000Z",
"spacegroup": 139
},
{
"id": "mp-372",
"created_at": "2022-09-04T14:46:18.416526Z",
"structure_string": "V1 Pt3\n1.0\n3.924725 0.000000 0.000000\n0.000000 3.924725 0.000000\n0.000000 0.000000 3.924725\nV Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 V\n0.500000 0.500000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n0.000000 0.500000 0.500000 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"V",
"Pt"
],
"chemical_system": "Pt-V",
"density": 17.47473626127471,
"density_atomic": 0.06616560624755803,
"volume": 60.45436937483858,
"volume_molar": 9.10161804830778,
"formula_full": "V1 Pt3",
"formula_reduced": "VPt3",
"formula_anonymous": "AB3",
"energy": -29.03531358,
"energy_per_atom": -7.258828395,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -29.03531358,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.2339779,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:28.613000Z",
"spacegroup": 221
},
{
"id": "mp-1216270",
"created_at": "2022-09-04T14:42:02.770614Z",
"structure_string": "V1 Pt3\n1.0\n9.130224 -1.385181 0.000000\n9.130224 1.385181 0.000000\n8.920073 0.000000 2.389982\nV Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 V\n0.256142 0.256142 0.256142 Pt\n0.500000 0.500000 0.500000 Pt\n0.743858 0.743858 0.743858 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"V",
"Pt"
],
"chemical_system": "Pt-V",
"density": 17.475344293655105,
"density_atomic": 0.06616790847578428,
"volume": 60.45226594193914,
"volume_molar": 9.101301369082789,
"formula_full": "V1 Pt3",
"formula_reduced": "VPt3",
"formula_anonymous": "AB3",
"energy": -28.45045536,
"energy_per_atom": -7.11261384,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -28.45045536,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0022532,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:39.459000Z",
"spacegroup": 166
},
{
"id": "mp-1067236",
"created_at": "2022-09-04T14:42:26.434048Z",
"structure_string": "Cd1 Pt3\n1.0\n2.902652 -3.964206 0.000000\n2.902652 3.964206 0.000000\n0.000000 0.000000 2.880530\nCd Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.000000 Pt\n0.000000 0.500000 0.500000 Pt\n0.500000 0.000000 0.500000 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cd",
"Pt"
],
"chemical_system": "Cd-Pt",
"density": 17.475966540149546,
"density_atomic": 0.06034015302987281,
"volume": 66.29084944513988,
"volume_molar": 9.980320661465006,
"formula_full": "Cd1 Pt3",
"formula_reduced": "CdPt3",
"formula_anonymous": "AB3",
"energy": -19.85202397,
"energy_per_atom": -4.9630059925,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -19.85202397,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0020745,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:50.985000Z",
"spacegroup": 65
},
{
"id": "mp-631311",
"created_at": "2022-09-04T14:43:02.893321Z",
"structure_string": "Ir1 Os1 W1\n1.0\n0.000000 2.996382 2.996382\n2.996382 0.000000 2.996382\n2.996382 2.996382 0.000000\nIr Os W\n1 1 1\ndirect\n0.500000 0.500000 0.500000 Ir\n0.750000 0.750000 0.750000 Os\n0.000000 0.000000 0.000000 W\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ir",
"Os",
"W"
],
"chemical_system": "Ir-Os-W",
"density": 17.476890095442464,
"density_atomic": 0.055757041343793466,
"volume": 53.80486352391332,
"volume_molar": 10.800682057119854,
"formula_full": "Ir1 Os1 W1",
"formula_reduced": "IrOsW",
"formula_anonymous": "ABC",
"energy": -31.22344155,
"energy_per_atom": -10.40781385,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -31.22344155,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0039989,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:01.658000Z",
"spacegroup": 216
},
{
"id": "mp-1226746",
"created_at": "2022-09-04T14:47:10.891676Z",
"structure_string": "Cd1 Pt3\n1.0\n-2.041783 -2.041783 0.000000\n0.000000 2.041783 -2.041783\n5.980524 -3.938740 -5.980524\nCd Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Cd\n0.750837 0.249163 0.252512 Pt\n0.500000 0.500000 0.500000 Pt\n0.249163 0.750837 0.747488 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cd",
"Pt"
],
"chemical_system": "Cd-Pt",
"density": 17.477700294128255,
"density_atomic": 0.06034613924987107,
"volume": 66.28427352141746,
"volume_molar": 9.979330633007923,
"formula_full": "Cd1 Pt3",
"formula_reduced": "CdPt3",
"formula_anonymous": "AB3",
"energy": -19.34283307,
"energy_per_atom": -4.8357082675,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -19.34283307,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0159169,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:58.120000Z",
"spacegroup": 166
},
{
"id": "mp-1184606",
"created_at": "2022-09-04T14:45:21.780897Z",
"structure_string": "H2 Pt6\n1.0\n2.760716 -4.781701 0.000000\n2.760716 4.781701 0.000000\n0.000000 0.000000 4.218967\nH Pt\n2 6\ndirect\n0.333333 0.666667 0.750000 H\n0.666667 0.333333 0.250000 H\n0.171520 0.343039 0.250000 Pt\n0.656961 0.828480 0.250000 Pt\n0.171520 0.828480 0.250000 Pt\n0.828480 0.656961 0.750000 Pt\n0.343039 0.171520 0.750000 Pt\n0.828480 0.171520 0.750000 Pt\n",
"nsites": 8,
"nelements": 2,
"elements": [
"H",
"Pt"
],
"chemical_system": "H-Pt",
"density": 17.479501381569143,
"density_atomic": 0.07182071336533817,
"volume": 111.38847868727699,
"volume_molar": 8.384963721213026,
"formula_full": "H2 Pt6",
"formula_reduced": "HPt3",
"formula_anonymous": "AB3",
"energy": -39.06138248,
"energy_per_atom": -4.88267281,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -38.70338248,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0032896,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:05.448000Z",
"spacegroup": 194
},
{
"id": "mp-980203",
"created_at": "2022-09-04T14:41:02.613673Z",
"structure_string": "Ti1 Os3\n1.0\n3.887734 0.000000 0.000000\n0.000000 3.887734 0.000000\n0.000000 0.000000 3.887734\nTi Os\n1 3\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500000 0.000000 Os\n0.500000 0.000000 0.500000 Os\n0.000000 0.500000 0.500000 Os\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ti",
"Os"
],
"chemical_system": "Os-Ti",
"density": 17.47991012707147,
"density_atomic": 0.06807229037501912,
"volume": 58.76106089516716,
"volume_molar": 8.846684497940707,
"formula_full": "Ti1 Os3",
"formula_reduced": "TiOs3",
"formula_anonymous": "AB3",
"energy": -42.11265738,
"energy_per_atom": -10.528164345,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -42.11265738,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0059026,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:09.581000Z",
"spacegroup": 221
},
{
"id": "mp-974445",
"created_at": "2022-09-04T14:46:41.477662Z",
"structure_string": "Re3 Ge1\n1.0\n-1.902172 1.902172 4.142901\n1.902172 -1.902172 4.142901\n1.902172 1.902172 -4.142901\nRe Ge\n3 1\ndirect\n0.750000 0.250000 0.500000 Re\n0.250000 0.750000 0.500000 Re\n0.500000 0.500000 0.000000 Re\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Re",
"Ge"
],
"chemical_system": "Ge-Re",
"density": 17.482113704496808,
"density_atomic": 0.06671075802065217,
"volume": 59.96034400870829,
"volume_molar": 9.027240790961601,
"formula_full": "Re3 Ge1",
"formula_reduced": "Re3Ge",
"formula_anonymous": "AB3",
"energy": -40.4355676,
"energy_per_atom": -10.1088919,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -40.4355676,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0137068,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:43.201000Z",
"spacegroup": 139
},
{
"id": "mp-1221728",
"created_at": "2022-09-04T14:46:05.730663Z",
"structure_string": "Mn1 Cr1 Pt6\n1.0\n3.936810 0.000000 0.000000\n0.000000 3.936810 0.000000\n0.000000 0.000000 7.826403\nMn Cr Pt\n1 1 6\ndirect\n0.000000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Cr\n0.500000 0.500000 0.000000 Pt\n0.500000 0.500000 0.500000 Pt\n0.500000 0.000000 0.248191 Pt\n0.500000 0.000000 0.751809 Pt\n0.000000 0.500000 0.248191 Pt\n0.000000 0.500000 0.751809 Pt\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mn",
"Cr",
"Pt"
],
"chemical_system": "Cr-Mn-Pt",
"density": 17.487908019876937,
"density_atomic": 0.0659536552229862,
"volume": 121.29729539556796,
"volume_molar": 9.130867333492628,
"formula_full": "Mn1 Cr1 Pt6",
"formula_reduced": "MnCrPt6",
"formula_anonymous": "ABC6",
"energy": -57.59246265,
"energy_per_atom": -7.19905783125,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -57.59246265,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 6.806001,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:19.380000Z",
"spacegroup": 123
},
{
"id": "mp-1761",
"created_at": "2022-09-04T14:40:39.663231Z",
"structure_string": "Lu2 Ir4\n1.0\n0.000000 3.758810 3.758810\n3.758810 0.000000 3.758810\n3.758810 3.758810 0.000000\nLu Ir\n2 4\ndirect\n0.250000 0.250000 0.250000 Lu\n0.000000 0.000000 0.000000 Lu\n0.625000 0.125000 0.625000 Ir\n0.625000 0.625000 0.125000 Ir\n0.125000 0.625000 0.625000 Ir\n0.625000 0.625000 0.625000 Ir\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Lu",
"Ir"
],
"chemical_system": "Ir-Lu",
"density": 17.491264819216028,
"density_atomic": 0.056489812593196846,
"volume": 106.21384147984568,
"volume_molar": 10.660578400865955,
"formula_full": "Lu2 Ir4",
"formula_reduced": "LuIr2",
"formula_anonymous": "AB2",
"energy": -49.45978205,
"energy_per_atom": -8.243297008333334,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -49.45978205,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0265458,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:07.886000Z",
"spacegroup": 227
},
{
"id": "mp-1438",
"created_at": "2022-09-04T14:47:32.384073Z",
"structure_string": "Zr1 Ir3\n1.0\n3.987559 0.000000 0.000000\n0.000000 3.987559 0.000000\n0.000000 0.000000 3.987559\nZr Ir\n1 3\ndirect\n0.000000 0.000000 0.000000 Zr\n0.500000 0.500000 0.000000 Ir\n0.500000 0.000000 0.500000 Ir\n0.000000 0.500000 0.500000 Ir\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zr",
"Ir"
],
"chemical_system": "Ir-Zr",
"density": 17.491333437637753,
"density_atomic": 0.06308681838844145,
"volume": 63.404687416172926,
"volume_molar": 9.545798811599854,
"formula_full": "Zr1 Ir3",
"formula_reduced": "ZrIr3",
"formula_anonymous": "AB3",
"energy": -37.96603433,
"energy_per_atom": -9.4915085825,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -37.96603433,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0042318,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:12.614000Z",
"spacegroup": 221
}
]
}