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=-spacegroup&page=1768",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-spacegroup&page=1766",
"results": [
{
"id": "mp-203",
"created_at": "2022-09-04T14:48:22.264612Z",
"structure_string": "Ni2 Te2\n1.0\n2.009733 -3.480960 0.000000\n2.009733 3.480960 0.000000\n0.000000 0.000000 5.270864\nNi Te\n2 2\ndirect\n0.000000 0.000000 0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.333333 0.666667 0.250000 Te\n0.666667 0.333333 0.750000 Te\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ni",
"Te"
],
"chemical_system": "Ni-Te",
"density": 8.389331571115452,
"density_atomic": 0.05423888943035925,
"volume": 73.74782267870462,
"volume_molar": 11.102994222866986,
"formula_full": "Ni2 Te2",
"formula_reduced": "NiTe",
"formula_anonymous": "AB",
"energy": -19.44366101,
"energy_per_atom": -4.8609152525,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -18.59966101,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0017585,
"is_theoretical": false,
"updated_at": "2021-11-28T01:39:16.539000Z",
"spacegroup": 194
},
{
"id": "mp-7180",
"created_at": "2022-09-04T14:48:22.313803Z",
"structure_string": "U4 Ge4 Au4\n1.0\n2.225383 -3.854476 0.000000\n2.225383 3.854476 0.000000\n0.000000 0.000000 15.157861\nU Ge Au\n4 4 4\ndirect\n0.000000 0.000000 0.750000 U\n0.000000 0.000000 0.250000 U\n0.000000 0.000000 0.500000 U\n0.000000 0.000000 0.000000 U\n0.333333 0.666667 0.889403 Ge\n0.666667 0.333333 0.389403 Ge\n0.666667 0.333333 0.110597 Ge\n0.333333 0.666667 0.610597 Ge\n0.333333 0.666667 0.143056 Au\n0.666667 0.333333 0.643056 Au\n0.666667 0.333333 0.856944 Au\n0.333333 0.666667 0.356944 Au\n",
"nsites": 12,
"nelements": 3,
"elements": [
"U",
"Ge",
"Au"
],
"chemical_system": "Au-Ge-U",
"density": 12.96650788870749,
"density_atomic": 0.046146972933563506,
"volume": 260.03872490783004,
"volume_molar": 13.049915037048924,
"formula_full": "U4 Ge4 Au4",
"formula_reduced": "UGeAu",
"formula_anonymous": "ABC",
"energy": -77.48176104,
"energy_per_atom": -6.45681342,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -77.48176104,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.5477958,
"is_theoretical": false,
"updated_at": "2021-11-28T01:39:31.240000Z",
"spacegroup": 194
},
{
"id": "mp-11818",
"created_at": "2022-09-04T14:48:23.793880Z",
"structure_string": "Ba2 Zn2 Ge2\n1.0\n2.242766 -3.884585 0.000000\n2.242766 3.884585 0.000000\n0.000000 0.000000 9.796787\nBa Zn Ge\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Ba\n0.000000 0.000000 0.000000 Ba\n0.666667 0.333333 0.250000 Zn\n0.333333 0.666667 0.750000 Zn\n0.333333 0.666667 0.250000 Ge\n0.666667 0.333333 0.750000 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"Ge"
],
"chemical_system": "Ba-Ge-Zn",
"density": 5.357509211776616,
"density_atomic": 0.035148678106441816,
"volume": 170.70343248272428,
"volume_molar": 17.13333497710203,
"formula_full": "Ba2 Zn2 Ge2",
"formula_reduced": "BaZnGe",
"formula_anonymous": "ABC",
"energy": -18.54680224,
"energy_per_atom": -3.091133706666667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -18.54680224,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 8.5e-06,
"is_theoretical": false,
"updated_at": "2021-11-28T01:39:37.589000Z",
"spacegroup": 194
},
{
"id": "mp-1187221",
"created_at": "2022-09-04T14:48:22.693717Z",
"structure_string": "Sr2 Nd6\n1.0\n3.830746 -6.635047 0.000000\n3.830746 6.635047 0.000000\n0.000000 0.000000 6.082824\nSr Nd\n2 6\ndirect\n0.333333 0.666667 0.750000 Sr\n0.666667 0.333333 0.250000 Sr\n0.159939 0.319879 0.250000 Nd\n0.680121 0.840061 0.250000 Nd\n0.159939 0.840061 0.250000 Nd\n0.840061 0.680121 0.750000 Nd\n0.319879 0.159939 0.750000 Nd\n0.840061 0.159939 0.750000 Nd\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sr",
"Nd"
],
"chemical_system": "Nd-Sr",
"density": 5.588673095945798,
"density_atomic": 0.025871843778594472,
"volume": 309.2164620528105,
"volume_molar": 23.276813247390294,
"formula_full": "Sr2 Nd6",
"formula_reduced": "SrNd3",
"formula_anonymous": "AB3",
"energy": -30.84557085,
"energy_per_atom": -3.85569635625,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -30.84557085,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.3299926,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:53.603000Z",
"spacegroup": 194
},
{
"id": "mp-974365",
"created_at": "2022-09-04T14:48:22.723646Z",
"structure_string": "Ru2 Au6\n1.0\n2.922280 -5.061538 0.000000\n2.922280 5.061538 0.000000\n0.000000 0.000000 4.704786\nRu Au\n2 6\ndirect\n0.333333 0.666667 0.750000 Ru\n0.666667 0.333333 0.250000 Ru\n0.169034 0.338069 0.250000 Au\n0.661931 0.830966 0.250000 Au\n0.169034 0.830966 0.250000 Au\n0.830966 0.661931 0.750000 Au\n0.338069 0.169034 0.750000 Au\n0.830966 0.169034 0.750000 Au\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Ru",
"Au"
],
"chemical_system": "Au-Ru",
"density": 16.51170718279011,
"density_atomic": 0.05747987165977369,
"volume": 139.17915557210029,
"volume_molar": 10.476955821414077,
"formula_full": "Ru2 Au6",
"formula_reduced": "RuAu3",
"formula_anonymous": "AB3",
"energy": -35.0703768,
"energy_per_atom": -4.3837971,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -35.0703768,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 3.8407074,
"is_theoretical": true,
"updated_at": "2021-11-28T01:39:43.982000Z",
"spacegroup": 194
},
{
"id": "mp-1187548",
"created_at": "2022-09-04T14:48:25.244100Z",
"structure_string": "Yb2 Pr6\n1.0\n3.742111 -6.481527 0.000000\n3.742111 6.481527 0.000000\n0.000000 0.000000 6.031976\nYb Pr\n2 6\ndirect\n0.333333 0.666667 0.750000 Yb\n0.666667 0.333333 0.250000 Yb\n0.165180 0.330360 0.250000 Pr\n0.669640 0.834820 0.250000 Pr\n0.165180 0.834820 0.250000 Pr\n0.834820 0.669640 0.750000 Pr\n0.330360 0.165180 0.750000 Pr\n0.834820 0.165180 0.750000 Pr\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Yb",
"Pr"
],
"chemical_system": "Pr-Yb",
"density": 6.761903736633318,
"density_atomic": 0.02734049582750869,
"volume": 292.60625156442063,
"volume_molar": 22.026450427211394,
"formula_full": "Yb2 Pr6",
"formula_reduced": "YbPr3",
"formula_anonymous": "AB3",
"energy": -31.22224972,
"energy_per_atom": -3.902781215,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -31.22224972,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0049655,
"is_theoretical": true,
"updated_at": "2021-11-28T01:39:06.806000Z",
"spacegroup": 194
},
{
"id": "mp-1185289",
"created_at": "2022-09-04T14:48:23.196577Z",
"structure_string": "Li6 Y2\n1.0\n3.284047 -5.688136 0.000000\n3.284047 5.688136 0.000000\n0.000000 0.000000 4.992786\nLi Y\n6 2\ndirect\n0.149769 0.299539 0.250000 Li\n0.700461 0.850231 0.250000 Li\n0.149769 0.850231 0.250000 Li\n0.850231 0.700461 0.750000 Li\n0.299539 0.149769 0.750000 Li\n0.850231 0.149769 0.750000 Li\n0.333333 0.666667 0.750000 Y\n0.666667 0.333333 0.250000 Y\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Li",
"Y"
],
"chemical_system": "Li-Y",
"density": 1.953653941148782,
"density_atomic": 0.0428881885994158,
"volume": 186.5315430950369,
"volume_molar": 14.04149010872898,
"formula_full": "Li6 Y2",
"formula_reduced": "Li3Y",
"formula_anonymous": "AB3",
"energy": -22.92227851,
"energy_per_atom": -2.86528481375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -22.92227851,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 1.0446216,
"is_theoretical": true,
"updated_at": "2021-11-28T01:39:24.684000Z",
"spacegroup": 194
},
{
"id": "mp-29663",
"created_at": "2022-09-04T14:48:23.461576Z",
"structure_string": "Si6 Ir2\n1.0\n2.189650 -3.792586 0.000000\n2.189650 3.792586 0.000000\n0.000000 0.000000 7.404951\nSi Ir\n6 2\ndirect\n0.333333 0.666667 0.914597 Si\n0.666667 0.333333 0.414597 Si\n0.000000 0.000000 0.250000 Si\n0.000000 0.000000 0.750000 Si\n0.333333 0.666667 0.585403 Si\n0.666667 0.333333 0.085403 Si\n0.666667 0.333333 0.750000 Ir\n0.333333 0.666667 0.250000 Ir\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Si",
"Ir"
],
"chemical_system": "Ir-Si",
"density": 7.465695624899483,
"density_atomic": 0.06504705867288964,
"volume": 122.98788236114736,
"volume_molar": 9.258129241914382,
"formula_full": "Si6 Ir2",
"formula_reduced": "Si3Ir",
"formula_anonymous": "AB3",
"energy": -49.12675978,
"energy_per_atom": -6.1408449725,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -49.55275978,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0005101,
"is_theoretical": false,
"updated_at": "2021-11-28T01:39:27.122000Z",
"spacegroup": 194
},
{
"id": "mp-1401965",
"created_at": "2022-09-04T14:48:26.061360Z",
"structure_string": "Y2 W2 O6\n1.0\n1.804290 -3.125121 0.000000\n1.804290 3.125121 0.000000\n0.000000 0.000000 12.690040\nY W O\n2 2 6\ndirect\n0.000000 0.000000 0.500000 Y\n0.000000 0.000000 0.000000 Y\n0.666667 0.333333 0.750000 W\n0.333333 0.666667 0.250000 W\n0.333333 0.666667 0.419091 O\n0.666667 0.333333 0.919091 O\n0.666667 0.333333 0.580909 O\n0.333333 0.666667 0.080909 O\n0.000000 0.000000 0.250000 O\n0.000000 0.000000 0.750000 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Y",
"W",
"O"
],
"chemical_system": "O-W-Y",
"density": 7.443403044832641,
"density_atomic": 0.06987693284549688,
"volume": 143.10874265346973,
"volume_molar": 8.618209922458107,
"formula_full": "Y2 W2 O6",
"formula_reduced": "YWO3",
"formula_anonymous": "ABC3",
"energy": -94.07761546,
"energy_per_atom": -9.407761546,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -81.07961546,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 5.5214355,
"is_theoretical": true,
"updated_at": "2021-11-28T01:39:40.016000Z",
"spacegroup": 194
},
{
"id": "mp-1193669",
"created_at": "2022-09-04T14:48:23.607472Z",
"structure_string": "Hf18 Re8 As2\n1.0\n-4.301691 -7.479953 0.000000\n-4.301691 7.479953 0.000000\n0.000000 0.000000 -8.646236\nHf Re As\n18 8 2\ndirect\n0.806249 0.612003 0.544871 Hf\n0.805099 0.194901 0.544626 Hf\n0.387997 0.193751 0.544871 Hf\n0.193751 0.387997 0.455129 Hf\n0.194901 0.805099 0.455374 Hf\n0.612003 0.806249 0.455129 Hf\n0.193751 0.387997 0.044871 Hf\n0.194901 0.805099 0.044626 Hf\n0.612003 0.806249 0.044871 Hf\n0.806249 0.612003 0.955129 Hf\n0.805099 0.194901 0.955374 Hf\n0.387997 0.193751 0.955129 Hf\n0.459639 0.918887 0.750000 Hf\n0.459319 0.540681 0.750000 Hf\n0.081113 0.540361 0.750000 Hf\n0.540361 0.081113 0.250000 Hf\n0.540681 0.459319 0.250000 Hf\n0.918887 0.459639 0.250000 Hf\n0.108624 0.217485 0.750000 Re\n0.109098 0.890902 0.750000 Re\n0.782515 0.891376 0.750000 Re\n0.891376 0.782515 0.250000 Re\n0.890902 0.109098 0.250000 Re\n0.217485 0.108624 0.250000 Re\n0.000000 0.000000 0.500000 Re\n0.000000 0.000000 0.000000 Re\n0.666711 0.333289 0.750000 As\n0.333289 0.666711 0.250000 As\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Hf",
"Re",
"As"
],
"chemical_system": "As-Hf-Re",
"density": 14.48115822578136,
"density_atomic": 0.05032257668748338,
"volume": 556.410300169792,
"volume_molar": 11.967075528344068,
"formula_full": "Hf18 Re8 As2",
"formula_reduced": "Hf9Re4As",
"formula_anonymous": "AB4C9",
"energy": -299.55776596,
"energy_per_atom": -10.698491641428571,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -299.55776596,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0289585,
"is_theoretical": false,
"updated_at": "2021-11-28T01:39:01.273000Z",
"spacegroup": 194
},
{
"id": "mp-1079635",
"created_at": "2022-09-04T14:48:23.642249Z",
"structure_string": "Ga2 Mo4 C2\n1.0\n1.531355 -2.652385 0.000000\n1.531355 2.652385 0.000000\n0.000000 0.000000 13.240542\nGa Mo C\n2 4 2\ndirect\n0.333333 0.666667 0.750000 Ga\n0.666667 0.333333 0.250000 Ga\n0.333333 0.666667 0.410709 Mo\n0.666667 0.333333 0.589291 Mo\n0.666667 0.333333 0.910709 Mo\n0.333333 0.666667 0.089291 Mo\n0.000000 0.000000 0.500000 C\n0.000000 0.000000 0.000000 C\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ga",
"Mo",
"C"
],
"chemical_system": "C-Ga-Mo",
"density": 8.448288363392336,
"density_atomic": 0.07437753551521817,
"volume": 107.55935840820034,
"volume_molar": 8.0967199548684,
"formula_full": "Ga2 Mo4 C2",
"formula_reduced": "GaMo2C",
"formula_anonymous": "ABC2",
"energy": -68.81949019,
"energy_per_atom": -8.60243627375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -68.81949019,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0022195,
"is_theoretical": false,
"updated_at": "2021-11-28T01:39:28.796000Z",
"spacegroup": 194
},
{
"id": "mp-604321",
"created_at": "2022-09-04T14:48:24.360907Z",
"structure_string": "Rb4\n1.0\n2.538581 -4.396951 0.000000\n2.538581 4.396951 0.000000\n0.000000 0.000000 16.471521\nRb\n4\ndirect\n0.000000 0.000000 0.000000 Rb\n0.333333 0.666667 0.750000 Rb\n0.000000 0.000000 0.500000 Rb\n0.666667 0.333333 0.250000 Rb\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Rb"
],
"chemical_system": "Rb",
"density": 1.5438505712149497,
"density_atomic": 0.01087811486369811,
"volume": 367.7107706730139,
"volume_molar": 55.36015049902424,
"formula_full": "Rb4",
"formula_reduced": "Rb",
"formula_anonymous": "A",
"energy": -3.91319338,
"energy_per_atom": -0.978298345,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -3.91319338,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0007881,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:57.601000Z",
"spacegroup": 194
}
]
}