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=-nsites&page=11489",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-nsites&page=11487",
"results": [
{
"id": "mp-1185336",
"created_at": "2022-09-04T14:46:55.393488Z",
"structure_string": "Li1 Ge3\n1.0\n-2.040589 2.040589 4.350707\n2.040589 -2.040589 4.350707\n2.040589 2.040589 -4.350707\nLi Ge\n1 3\ndirect\n0.000000 0.000000 0.000000 Li\n0.750000 0.250000 0.500000 Ge\n0.250000 0.750000 0.500000 Ge\n0.500000 0.500000 0.000000 Ge\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"Ge"
],
"chemical_system": "Ge-Li",
"density": 5.152669948805963,
"density_atomic": 0.05519872940573037,
"volume": 72.46543612622986,
"volume_molar": 10.909926414673635,
"formula_full": "Li1 Ge3",
"formula_reduced": "LiGe3",
"formula_anonymous": "AB3",
"energy": -15.75570969,
"energy_per_atom": -3.9389274225,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.75570969,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0003919,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:48.349000Z",
"spacegroup": 139
},
{
"id": "mp-972370",
"created_at": "2022-09-04T14:46:54.702012Z",
"structure_string": "Yb2 In1 Hg1\n1.0\n0.000000 3.788909 3.788909\n3.788909 0.000000 3.788909\n3.788909 3.788909 0.000000\nYb In Hg\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Yb\n0.750000 0.750000 0.750000 Yb\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.500000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"In",
"Hg"
],
"chemical_system": "Hg-In-Yb",
"density": 10.097143946033505,
"density_atomic": 0.03676947859251204,
"volume": 108.78587766579274,
"volume_molar": 16.378096700088605,
"formula_full": "Yb2 In1 Hg1",
"formula_reduced": "Yb2InHg",
"formula_anonymous": "ABC2",
"energy": -8.38348491,
"energy_per_atom": -2.0958712275,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.38348491,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0027113,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:42.541000Z",
"spacegroup": 225
},
{
"id": "mp-973066",
"created_at": "2022-09-04T14:46:40.313045Z",
"structure_string": "Sc1 Ge1 Rh2\n1.0\n0.000000 3.129542 3.129542\n3.129542 0.000000 3.129542\n3.129542 3.129542 0.000000\nSc Ge Rh\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Sc\n0.000000 0.000000 0.000000 Ge\n0.750000 0.750000 0.750000 Rh\n0.250000 0.250000 0.250000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Ge",
"Rh"
],
"chemical_system": "Ge-Rh-Sc",
"density": 8.760442557501609,
"density_atomic": 0.06525107072467348,
"volume": 61.30167605797577,
"volume_molar": 9.229183051126299,
"formula_full": "Sc1 Ge1 Rh2",
"formula_reduced": "ScGeRh2",
"formula_anonymous": "ABC2",
"energy": -29.04487081,
"energy_per_atom": -7.2612177025,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -29.04487081,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.4081893,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:41.663000Z",
"spacegroup": 225
},
{
"id": "mp-1187667",
"created_at": "2022-09-04T14:46:59.421909Z",
"structure_string": "Yb1 Eu1 Au2\n1.0\n0.000000 3.682026 3.682026\n3.682026 0.000000 3.682026\n3.682026 3.682026 0.000000\nYb Eu Au\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.500000 Eu\n0.750000 0.750000 0.750000 Au\n0.250000 0.250000 0.250000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Eu",
"Au"
],
"chemical_system": "Au-Eu-Yb",
"density": 11.957749951119093,
"density_atomic": 0.04006539631753331,
"volume": 99.83677606227823,
"volume_molar": 15.030777961790951,
"formula_full": "Yb1 Eu1 Au2",
"formula_reduced": "YbEuAu2",
"formula_anonymous": "ABC2",
"energy": -21.80814947,
"energy_per_atom": -5.4520373675,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -21.80814947,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.102196,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:44.885000Z",
"spacegroup": 225
},
{
"id": "mp-1184607",
"created_at": "2022-09-04T14:46:55.043948Z",
"structure_string": "Hf1 Zr1 Os2\n1.0\n0.000000 3.276320 3.276320\n3.276320 0.000000 3.276320\n3.276320 3.276320 0.000000\nHf Zr Os\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Hf\n0.000000 0.000000 0.000000 Zr\n0.250000 0.250000 0.250000 Os\n0.750000 0.750000 0.750000 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Zr",
"Os"
],
"chemical_system": "Hf-Os-Zr",
"density": 15.349341950311736,
"density_atomic": 0.05686840619901385,
"volume": 70.33782494275994,
"volume_molar": 10.589607063938484,
"formula_full": "Hf1 Zr1 Os2",
"formula_reduced": "HfZrOs2",
"formula_anonymous": "ABC2",
"energy": -43.41360933,
"energy_per_atom": -10.8534023325,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -43.41360933,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 5.1e-06,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:48.578000Z",
"spacegroup": 225
},
{
"id": "mp-30825",
"created_at": "2022-09-04T14:46:59.158700Z",
"structure_string": "Pa1 Rh3\n1.0\n4.064642 0.000000 0.000000\n0.000000 4.064642 0.000000\n0.000000 0.000000 4.064642\nPa Rh\n1 3\ndirect\n0.000000 0.000000 0.000000 Pa\n0.500000 0.000000 0.500000 Rh\n0.000000 0.500000 0.500000 Rh\n0.500000 0.500000 0.000000 Rh\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pa",
"Rh"
],
"chemical_system": "Pa-Rh",
"density": 13.346788000437767,
"density_atomic": 0.05956526662118025,
"volume": 67.1532291702641,
"volume_molar": 10.11015496379671,
"formula_full": "Pa1 Rh3",
"formula_reduced": "PaRh3",
"formula_anonymous": "AB3",
"energy": -35.14228403,
"energy_per_atom": -8.7855710075,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -35.14228403,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0008305,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:43.921000Z",
"spacegroup": 221
},
{
"id": "mp-1008556",
"created_at": "2022-09-04T14:46:41.207480Z",
"structure_string": "Al1 Ga1 N2\n1.0\n3.164181 0.000000 0.000000\n0.000000 3.164181 0.000000\n0.000000 0.000000 4.467331\nAl Ga N\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 Ga\n0.500000 0.000000 0.738781 N\n0.000000 0.500000 0.261219 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Ga",
"N"
],
"chemical_system": "Al-Ga-N",
"density": 4.630279982767957,
"density_atomic": 0.08943123382918129,
"volume": 44.72710292290304,
"volume_molar": 6.733822739718239,
"formula_full": "Al1 Ga1 N2",
"formula_reduced": "AlGaN2",
"formula_anonymous": "ABC2",
"energy": -27.86696592,
"energy_per_atom": -6.96674148,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -27.14496592,
"band_gap": 2.6642,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:44.970000Z",
"spacegroup": 115
},
{
"id": "mp-865630",
"created_at": "2022-09-04T14:46:59.431043Z",
"structure_string": "Yb2 Ag1 Ge1\n1.0\n0.000000 3.600959 3.600959\n3.600959 0.000000 3.600959\n3.600959 3.600959 0.000000\nYb Ag Ge\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Yb\n0.750000 0.750000 0.750000 Yb\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Ag",
"Ge"
],
"chemical_system": "Ag-Ge-Yb",
"density": 9.363445673820582,
"density_atomic": 0.04283270142843844,
"volume": 93.38659170687355,
"volume_molar": 14.059680008886028,
"formula_full": "Yb2 Ag1 Ge1",
"formula_reduced": "Yb2AgGe",
"formula_anonymous": "ABC2",
"energy": -12.82840116,
"energy_per_atom": -3.20710029,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.82840116,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 7.91e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:50.488000Z",
"spacegroup": 225
},
{
"id": "mp-1065265",
"created_at": "2022-09-04T14:46:52.678312Z",
"structure_string": "Na1 N3\n1.0\n2.531184 3.591620 0.000000\n-2.531184 3.591620 0.000000\n0.000000 2.533001 4.049653\nNa N\n1 3\ndirect\n0.000000 0.000000 0.000000 Na\n0.000000 0.000000 0.500000 N\n0.547790 0.547790 0.361179 N\n0.452210 0.452210 0.638821 N\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Na",
"N"
],
"chemical_system": "N-Na",
"density": 1.466109760447512,
"density_atomic": 0.05432479374507644,
"volume": 73.63120454299981,
"volume_molar": 11.085436952157407,
"formula_full": "Na1 N3",
"formula_reduced": "NaN3",
"formula_anonymous": "AB3",
"energy": -23.75343881,
"energy_per_atom": -5.9383597025,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -22.67043881,
"band_gap": 0.7455999999999999,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.9999145,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:39.680000Z",
"spacegroup": 12
},
{
"id": "mp-1096026",
"created_at": "2022-09-04T14:46:52.316055Z",
"structure_string": "Ca2 Zn1 Sn1\n1.0\n-6.201203 6.348346 8.962368\n6.201203 -6.348346 8.962368\n6.201203 6.348346 -8.962368\nCa Zn Sn\n2 1 1\ndirect\n0.000000 0.258552 0.258552 Ca\n0.000000 0.741448 0.741448 Ca\n0.000000 0.000000 0.000000 Zn\n0.000000 0.500000 0.500000 Sn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Zn",
"Sn"
],
"chemical_system": "Ca-Sn-Zn",
"density": 0.3109466469599636,
"density_atomic": 0.0028342665443042976,
"volume": 1411.299868051699,
"volume_molar": 212.47616149941894,
"formula_full": "Ca2 Zn1 Sn1",
"formula_reduced": "Ca2ZnSn",
"formula_anonymous": "ABC2",
"energy": -4.51416422,
"energy_per_atom": -1.128541055,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -4.51416422,
"band_gap": 0.0038999999999997,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 2.0013837,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:44.184000Z",
"spacegroup": 71
},
{
"id": "mp-1097317",
"created_at": "2022-09-04T14:46:59.154274Z",
"structure_string": "Mg2 Zn1 Hg1\n1.0\n-5.940498 5.952421 8.400709\n5.940498 -5.952421 8.400709\n5.940498 5.952421 -8.400709\nMg Zn Hg\n2 1 1\ndirect\n0.751159 0.000000 0.751159 Mg\n0.248841 0.000000 0.248841 Mg\n0.000000 0.000000 0.000000 Zn\n0.500000 0.000000 0.500000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Zn",
"Hg"
],
"chemical_system": "Hg-Mg-Zn",
"density": 0.43967099190968173,
"density_atomic": 0.003366414314001105,
"volume": 1188.2078754726585,
"volume_molar": 178.88887695592254,
"formula_full": "Mg2 Zn1 Hg1",
"formula_reduced": "Mg2ZnHg",
"formula_anonymous": "ABC2",
"energy": -0.84484994,
"energy_per_atom": -0.211212485,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -0.84484994,
"band_gap": 0.2487999999999999,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 8.02e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:50.598000Z",
"spacegroup": 71
},
{
"id": "mp-1184077",
"created_at": "2022-09-04T14:46:40.263489Z",
"structure_string": "Er2 Zn1 Ga1\n1.0\n0.000000 3.537977 3.537977\n3.537977 0.000000 3.537977\n3.537977 3.537977 0.000000\nEr Zn Ga\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Er\n0.750000 0.750000 0.750000 Er\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Er",
"Zn",
"Ga"
],
"chemical_system": "Er-Ga-Zn",
"density": 8.804980786583583,
"density_atomic": 0.04516114868879047,
"volume": 88.5717063479576,
"volume_molar": 13.334782074519655,
"formula_full": "Er2 Zn1 Ga1",
"formula_reduced": "Er2ZnGa",
"formula_anonymous": "ABC2",
"energy": -15.36858838,
"energy_per_atom": -3.842147095,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -15.36858838,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0026049,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:49.133000Z",
"spacegroup": 225
}
]
}