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=22",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-density&page=20",
"results": [
{
"id": "mp-1186354",
"created_at": "2022-09-04T14:44:12.817651Z",
"structure_string": "Os3 F1\n1.0\n0.000000 3.005195 3.005195\n3.005195 0.000000 3.005195\n3.005195 3.005195 0.000000\nOs F\n3 1\ndirect\n0.750000 0.750000 0.750000 Os\n0.250000 0.250000 0.250000 Os\n0.500000 0.500000 0.500000 Os\n0.000000 0.000000 0.000000 F\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Os",
"F"
],
"chemical_system": "F-Os",
"density": 18.03946760069141,
"density_atomic": 0.07369058816476011,
"volume": 54.28101606485558,
"volume_molar": 8.17219798345954,
"formula_full": "Os3 F1",
"formula_reduced": "Os3F",
"formula_anonymous": "AB3",
"energy": -34.177063710000006,
"energy_per_atom": -8.544265927500001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -33.71506371,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0006038,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:31.647000Z",
"spacegroup": 225
},
{
"id": "mp-1226089",
"created_at": "2022-09-04T14:44:27.663682Z",
"structure_string": "Co1 Pt3\n1.0\n9.046161 -1.378297 0.000000\n9.046161 1.378297 0.000000\n8.836160 0.000000 2.378026\nCo Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Co\n0.256048 0.256048 0.256048 Pt\n0.500000 0.500000 0.500000 Pt\n0.743952 0.743952 0.743952 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Co",
"Pt"
],
"chemical_system": "Co-Pt",
"density": 18.03873667248255,
"density_atomic": 0.06745377711563506,
"volume": 59.299866827959185,
"volume_molar": 8.927803627180623,
"formula_full": "Co1 Pt3",
"formula_reduced": "CoPt3",
"formula_anonymous": "AB3",
"energy": -25.43754798,
"energy_per_atom": -6.359386995,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -25.43754798,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.8538856,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:41.704000Z",
"spacegroup": 166
},
{
"id": "mp-510400",
"created_at": "2022-09-04T14:46:14.973994Z",
"structure_string": "Gd1 Ir3\n1.0\n4.072899 0.000000 0.000000\n0.000000 4.072899 0.000000\n0.000000 0.000000 4.072899\nGd Ir\n1 3\ndirect\n0.000000 0.000000 0.000000 Gd\n0.000000 0.500000 0.500000 Ir\n0.500000 0.500000 0.000000 Ir\n0.500000 0.000000 0.500000 Ir\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Gd",
"Ir"
],
"chemical_system": "Gd-Ir",
"density": 18.03747139010831,
"density_atomic": 0.05920373004165047,
"volume": 67.56331057495797,
"volume_molar": 10.171894162349833,
"formula_full": "Gd1 Ir3",
"formula_reduced": "GdIr3",
"formula_anonymous": "AB3",
"energy": -42.075912,
"energy_per_atom": -10.518978,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -42.075912,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 6.7178582,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:27.642000Z",
"spacegroup": 221
},
{
"id": "mp-1183477",
"created_at": "2022-09-04T14:46:11.818858Z",
"structure_string": "Bi1 Pt3\n1.0\n-2.046279 2.046279 4.365829\n2.046279 -2.046279 4.365829\n2.046279 2.046279 -4.365829\nBi Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Bi\n0.750000 0.250000 0.500000 Pt\n0.250000 0.750000 0.500000 Pt\n0.500000 0.500000 0.000000 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Bi",
"Pt"
],
"chemical_system": "Bi-Pt",
"density": 18.036002628015304,
"density_atomic": 0.05470204771861396,
"volume": 73.12340518906908,
"volume_molar": 11.00898597247721,
"formula_full": "Bi1 Pt3",
"formula_reduced": "BiPt3",
"formula_anonymous": "AB3",
"energy": -22.05418163,
"energy_per_atom": -5.5135454075,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -22.05418163,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002532,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:22.085000Z",
"spacegroup": 139
},
{
"id": "mp-1220360",
"created_at": "2022-09-04T14:47:59.136103Z",
"structure_string": "Nb1 Os3\n1.0\n1.390479 -2.408380 0.000000\n1.390479 2.408380 0.000000\n0.000000 0.000000 9.122905\nNb Os\n1 3\ndirect\n0.666667 0.333333 0.000000 Nb\n0.666667 0.333333 0.500000 Os\n0.333333 0.666667 0.265792 Os\n0.333333 0.666667 0.734208 Os\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Nb",
"Os"
],
"chemical_system": "Nb-Os",
"density": 18.034350722660598,
"density_atomic": 0.06546473240532237,
"volume": 61.101601626264255,
"volume_molar": 9.199061141370207,
"formula_full": "Nb1 Os3",
"formula_reduced": "NbOs3",
"formula_anonymous": "AB3",
"energy": -43.62296908,
"energy_per_atom": -10.90574227,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -43.62296908,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0070268,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:26.213000Z",
"spacegroup": 187
},
{
"id": "mp-81",
"created_at": "2022-09-04T14:39:13.991322Z",
"structure_string": "Au1\n1.0\n0.000000 2.085644 2.085644\n2.085644 0.000000 2.085644\n2.085644 2.085644 0.000000\nAu\n1\ndirect\n0.000000 0.000000 0.000000 Au\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Au"
],
"chemical_system": "Au",
"density": 18.02565607297311,
"density_atomic": 0.05511241768155413,
"volume": 18.144731116281537,
"volume_molar": 10.927012483459935,
"formula_full": "Au1",
"formula_reduced": "Au",
"formula_anonymous": "A",
"energy": -3.27388154,
"energy_per_atom": -3.27388154,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -3.27388154,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 5.36e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:32.101000Z",
"spacegroup": 225
},
{
"id": "mp-623",
"created_at": "2022-09-04T14:41:53.156564Z",
"structure_string": "Hg1 Pt1\n1.0\n3.023661 0.000000 0.000000\n0.000000 3.023661 0.000000\n0.000000 0.000000 3.987660\nHg Pt\n1 1\ndirect\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.500000 Pt\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Hg",
"Pt"
],
"chemical_system": "Hg-Pt",
"density": 18.021971241043683,
"density_atomic": 0.05485872087816884,
"volume": 36.45728460278236,
"volume_molar": 10.977544980266803,
"formula_full": "Hg1 Pt1",
"formula_reduced": "HgPt",
"formula_anonymous": "AB",
"energy": -6.26109174,
"energy_per_atom": -3.13054587,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -6.26109174,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 5.14e-05,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:35.703000Z",
"spacegroup": 123
},
{
"id": "mp-30854",
"created_at": "2022-09-04T14:39:31.992138Z",
"structure_string": "U2 Pt4\n1.0\n2.074838 -4.926175 0.000000\n2.074838 4.926175 0.000000\n0.000000 0.000000 5.666472\nU Pt\n2 4\ndirect\n0.670525 0.329475 0.750000 U\n0.329475 0.670525 0.250000 U\n0.000000 0.000000 0.000000 Pt\n0.000000 0.000000 0.500000 Pt\n0.362901 0.637099 0.750000 Pt\n0.637099 0.362901 0.250000 Pt\n",
"nsites": 6,
"nelements": 2,
"elements": [
"U",
"Pt"
],
"chemical_system": "Pt-U",
"density": 18.011012057256586,
"density_atomic": 0.05179817736273462,
"volume": 115.83419157749371,
"volume_molar": 11.62616344167456,
"formula_full": "U2 Pt4",
"formula_reduced": "UPt2",
"formula_anonymous": "AB2",
"energy": -51.06015947,
"energy_per_atom": -8.510026578333333,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -51.06015947,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0820231,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:27.279000Z",
"spacegroup": 63
},
{
"id": "mp-1184920",
"created_at": "2022-09-04T14:47:26.996586Z",
"structure_string": "Ho2 Os6\n1.0\n2.909899 -5.040092 0.000000\n2.909899 5.040092 0.000000\n0.000000 0.000000 4.624966\nHo Os\n2 6\ndirect\n0.333333 0.666667 0.750000 Ho\n0.666667 0.333333 0.250000 Ho\n0.158629 0.317258 0.250000 Os\n0.682742 0.841371 0.250000 Os\n0.158629 0.841371 0.250000 Os\n0.841371 0.682742 0.750000 Os\n0.317258 0.158629 0.750000 Os\n0.841371 0.158629 0.750000 Os\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ho",
"Os"
],
"chemical_system": "Ho-Os",
"density": 18.008514547636416,
"density_atomic": 0.05897053497480992,
"volume": 135.66097040525935,
"volume_molar": 10.212118242733325,
"formula_full": "Ho2 Os6",
"formula_reduced": "HoOs3",
"formula_anonymous": "AB3",
"energy": -73.50082311,
"energy_per_atom": -9.18760288875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -73.50082311,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0128928,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:08.425000Z",
"spacegroup": 194
},
{
"id": "mp-1220285",
"created_at": "2022-09-04T14:41:23.138937Z",
"structure_string": "Nb1 Pt4\n1.0\n11.648261 -1.415569 0.000000\n11.648261 1.415569 0.000000\n11.476233 0.000000 2.445795\nNb Pt\n1 4\ndirect\n0.000000 0.000000 0.000000 Nb\n0.601280 0.601280 0.601280 Pt\n0.199938 0.199938 0.199938 Pt\n0.800062 0.800062 0.800062 Pt\n0.398720 0.398720 0.398720 Pt\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Nb",
"Pt"
],
"chemical_system": "Nb-Pt",
"density": 17.978014115261484,
"density_atomic": 0.06199088254556883,
"volume": 80.65702236654808,
"volume_molar": 9.714558839476418,
"formula_full": "Nb1 Pt4",
"formula_reduced": "NbPt4",
"formula_anonymous": "AB4",
"energy": -35.70427543,
"energy_per_atom": -7.140855086,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -35.70427543,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0265101,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:15.812000Z",
"spacegroup": 166
},
{
"id": "mp-1183439",
"created_at": "2022-09-04T14:44:57.187691Z",
"structure_string": "Bi1 Pt3\n1.0\n4.186495 0.000000 0.000000\n0.000000 4.186495 0.000000\n0.000000 0.000000 4.186495\nBi Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Bi\n0.000000 0.500000 0.500000 Pt\n0.500000 0.000000 0.500000 Pt\n0.500000 0.500000 0.000000 Pt\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Bi",
"Pt"
],
"chemical_system": "Bi-Pt",
"density": 17.974009488949633,
"density_atomic": 0.054514026474586766,
"volume": 73.37561098820524,
"volume_molar": 11.046956443049366,
"formula_full": "Bi1 Pt3",
"formula_reduced": "BiPt3",
"formula_anonymous": "AB3",
"energy": -22.02511323,
"energy_per_atom": -5.5062783075,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -22.02511323,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0032985,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:49.791000Z",
"spacegroup": 221
},
{
"id": "mp-13100",
"created_at": "2022-09-04T14:47:19.500566Z",
"structure_string": "Mo1 Pt3\n1.0\n3.979521 0.000000 0.000000\n0.000000 3.979521 0.000000\n0.000000 0.000000 3.979521\nMo Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 Mo\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": [
"Mo",
"Pt"
],
"chemical_system": "Mo-Pt",
"density": 17.948420424410788,
"density_atomic": 0.06346986708758386,
"volume": 63.02203208461564,
"volume_molar": 9.488188704869788,
"formula_full": "Mo1 Pt3",
"formula_reduced": "MoPt3",
"formula_anonymous": "AB3",
"energy": -29.53940654,
"energy_per_atom": -7.384851635,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -29.53940654,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.9845589,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:03.616000Z",
"spacegroup": 221
}
]
}