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=chemical_system&page=103",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=chemical_system&page=101",
"results": [
{
"id": "mp-1226727",
"created_at": "2022-09-04T14:42:23.569621Z",
"structure_string": "Cd1 In1 Ag1 Te3\n1.0\n2.323576 7.724120 0.000000\n-2.323576 7.724120 0.000000\n0.000000 2.821728 5.974407\nCd In Ag Te\n1 1 1 3\ndirect\n0.664152 0.664152 0.335615 Cd\n0.335145 0.335145 0.655274 In\n0.000635 0.000635 0.005405 Ag\n0.499600 0.499600 0.245597 Te\n0.164544 0.164544 0.590751 Te\n0.835927 0.835927 0.917357 Te\n",
"nsites": 6,
"nelements": 4,
"elements": [
"Cd",
"In",
"Ag",
"Te"
],
"chemical_system": "Ag-Cd-In-Te",
"density": 5.558795046763238,
"density_atomic": 0.027978250567770046,
"volume": 214.4522934150782,
"volume_molar": 21.524364954173702,
"formula_full": "Cd1 In1 Ag1 Te3",
"formula_reduced": "CdInAgTe3",
"formula_anonymous": "ABCD3",
"energy": -19.17936512,
"energy_per_atom": -3.196560853333333,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -17.91336512,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.000751,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:48.543000Z",
"spacegroup": 8
},
{
"id": "mp-1226959",
"created_at": "2022-09-04T14:47:10.701165Z",
"structure_string": "Cd2 In1 Ag1 Te4\n1.0\n0.000000 0.000000 -6.614266\n6.614266 0.000000 0.000000\n3.307133 -6.557363 -3.307133\nCd In Ag Te\n2 1 1 4\ndirect\n0.250000 0.750000 0.500000 Cd\n0.750000 0.250000 0.500000 Cd\n0.500000 0.500000 0.000000 In\n0.000000 0.000000 0.000000 Ag\n0.370960 0.874413 0.754627 Te\n0.629040 0.629040 0.245373 Te\n0.874413 0.370960 0.754627 Te\n0.125587 0.125587 0.245373 Te\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Cd",
"In",
"Ag",
"Te"
],
"chemical_system": "Ag-Cd-In-Te",
"density": 5.544730592384643,
"density_atomic": 0.027886720765232218,
"volume": 286.874891721726,
"volume_molar": 21.595012230724908,
"formula_full": "Cd2 In1 Ag1 Te4",
"formula_reduced": "Cd2InAgTe4",
"formula_anonymous": "ABC2D4",
"energy": -24.64662107,
"energy_per_atom": -3.08082763375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -22.95862107,
"band_gap": 0.3005999999999997,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0009155,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:59.528000Z",
"spacegroup": 121
},
{
"id": "mp-1097134",
"created_at": "2022-09-04T14:43:10.658600Z",
"structure_string": "La2 Cd1 Ag1\n1.0\n-5.849968 6.021407 8.404536\n5.849968 -6.021407 8.404536\n5.849968 6.021407 -8.404536\nLa Cd Ag\n2 1 1\ndirect\n0.000000 0.238918 0.238918 La\n0.000000 0.761082 0.761082 La\n0.000000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Cd",
"Ag"
],
"chemical_system": "Ag-Cd-La",
"density": 0.6984443933760851,
"density_atomic": 0.0033778066366839904,
"volume": 1184.2004087974733,
"volume_molar": 178.28553874569818,
"formula_full": "La2 Cd1 Ag1",
"formula_reduced": "La2CdAg",
"formula_anonymous": "ABC2",
"energy": -5.8990746,
"energy_per_atom": -1.47476865,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -5.8990746,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.9516966,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:09.365000Z",
"spacegroup": 71
},
{
"id": "mp-867225",
"created_at": "2022-09-04T14:48:09.907370Z",
"structure_string": "La1 Cd1 Ag2\n1.0\n0.000000 3.633884 3.633884\n3.633884 0.000000 3.633884\n3.633884 3.633884 0.000000\nLa Cd Ag\n1 1 2\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.500000 Cd\n0.750000 0.750000 0.750000 Ag\n0.250000 0.250000 0.250000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Cd",
"Ag"
],
"chemical_system": "Ag-Cd-La",
"density": 8.081127663522192,
"density_atomic": 0.04167895450986385,
"volume": 95.97169715601551,
"volume_molar": 14.448876731240427,
"formula_full": "La1 Cd1 Ag2",
"formula_reduced": "LaCdAg2",
"formula_anonymous": "ABC2",
"energy": -12.6671272,
"energy_per_atom": -3.1667818,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.6671272,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.1183062,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:32.608000Z",
"spacegroup": 225
},
{
"id": "mp-1097341",
"created_at": "2022-09-04T14:40:36.829506Z",
"structure_string": "La1 Cd2 Ag1\n1.0\n-5.942965 6.377883 8.961954\n5.942965 -6.377883 8.961954\n5.942965 6.377883 -8.961954\nLa Cd Ag\n1 2 1\ndirect\n0.000000 0.500000 0.500000 La\n0.000000 0.231785 0.231785 Cd\n0.000000 0.768215 0.768215 Cd\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Cd",
"Ag"
],
"chemical_system": "Ag-Cd-La",
"density": 0.5763369767867764,
"density_atomic": 0.0029438628226609864,
"volume": 1358.758964313548,
"volume_molar": 204.56594355020007,
"formula_full": "La1 Cd2 Ag1",
"formula_reduced": "LaCd2Ag",
"formula_anonymous": "ABC2",
"energy": -4.0535213,
"energy_per_atom": -1.013380325,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -4.0535213,
"band_gap": 0.0950999999999999,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 2.0,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:06.597000Z",
"spacegroup": 71
},
{
"id": "mp-867204",
"created_at": "2022-09-04T14:41:18.486268Z",
"structure_string": "Li1 Cd2 Ag1\n1.0\n0.000000 3.361774 3.361774\n3.361774 0.000000 3.361774\n3.361774 3.361774 0.000000\nLi Cd Ag\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.750000 0.750000 0.750000 Cd\n0.250000 0.250000 0.250000 Cd\n0.500000 0.500000 0.500000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Cd",
"Ag"
],
"chemical_system": "Ag-Cd-Li",
"density": 7.422003235046838,
"density_atomic": 0.05264103912487842,
"volume": 75.98634195861798,
"volume_molar": 11.440011177807289,
"formula_full": "Li1 Cd2 Ag1",
"formula_reduced": "LiCd2Ag",
"formula_anonymous": "ABC2",
"energy": -7.40991586,
"energy_per_atom": -1.852478965,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -7.40991586,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0001093,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:18.772000Z",
"spacegroup": 225
},
{
"id": "mp-867872",
"created_at": "2022-09-04T14:40:37.278144Z",
"structure_string": "Li1 Cd1 Ag2\n1.0\n0.000000 3.317705 3.317705\n3.317705 0.000000 3.317705\n3.317705 3.317705 0.000000\nLi Cd Ag\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Cd\n0.750000 0.750000 0.750000 Ag\n0.250000 0.250000 0.250000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Cd",
"Ag"
],
"chemical_system": "Ag-Cd-Li",
"density": 7.618424951969428,
"density_atomic": 0.05476671522632358,
"volume": 73.03706244696237,
"volume_molar": 10.995986768812935,
"formula_full": "Li1 Cd1 Ag2",
"formula_reduced": "LiCdAg2",
"formula_anonymous": "ABC2",
"energy": -9.21334304,
"energy_per_atom": -2.30333576,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -9.21334304,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0735621,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:05.899000Z",
"spacegroup": 225
},
{
"id": "mp-1096684",
"created_at": "2022-09-04T14:42:50.486442Z",
"structure_string": "Li2 Cd1 Ag1\n1.0\n-5.463878 5.614969 7.931864\n5.463878 -5.614969 7.931864\n5.463878 5.614969 -7.931864\nLi Cd Ag\n2 1 1\ndirect\n0.000000 0.236069 0.236069 Li\n0.000000 0.763931 0.763931 Li\n0.000000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Cd",
"Ag"
],
"chemical_system": "Ag-Cd-Li",
"density": 0.399466556146876,
"density_atomic": 0.004109380769931601,
"volume": 973.3826637015625,
"volume_molar": 146.5461853538638,
"formula_full": "Li2 Cd1 Ag1",
"formula_reduced": "Li2CdAg",
"formula_anonymous": "ABC2",
"energy": -4.49437143,
"energy_per_atom": -1.1235928575,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -4.49437143,
"band_gap": 0.4194999999999997,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.9999169,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:50.675000Z",
"spacegroup": 71
},
{
"id": "mp-1184976",
"created_at": "2022-09-04T14:40:13.110709Z",
"structure_string": "Li2 Cd1 Ag1\n1.0\n0.000000 3.253270 3.253270\n3.253270 0.000000 3.253270\n3.253270 3.253270 0.000000\nLi Cd Ag\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Li\n0.750000 0.750000 0.750000 Li\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.500000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Cd",
"Ag"
],
"chemical_system": "Ag-Cd-Li",
"density": 5.646426922538254,
"density_atomic": 0.05808575926384028,
"volume": 68.86369483148157,
"volume_molar": 10.367671588221663,
"formula_full": "Li2 Cd1 Ag1",
"formula_reduced": "Li2CdAg",
"formula_anonymous": "ABC2",
"energy": -8.5294042,
"energy_per_atom": -2.13235105,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -8.5294042,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0034875,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:49.265000Z",
"spacegroup": 225
},
{
"id": "mp-973956",
"created_at": "2022-09-04T14:45:28.433476Z",
"structure_string": "Lu2 Cd1 Ag1\n1.0\n0.000000 3.623729 3.623729\n3.623729 0.000000 3.623729\n3.623729 3.623729 0.000000\nLu Cd Ag\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Lu\n0.750000 0.750000 0.750000 Lu\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.500000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Lu",
"Cd",
"Ag"
],
"chemical_system": "Ag-Cd-Lu",
"density": 9.94922457114138,
"density_atomic": 0.042030335910125956,
"volume": 95.1693559754853,
"volume_molar": 14.32808144307299,
"formula_full": "Lu2 Cd1 Ag1",
"formula_reduced": "Lu2CdAg",
"formula_anonymous": "ABC2",
"energy": -14.04800855,
"energy_per_atom": -3.5120021375,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -14.04800855,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0018908,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:02.571000Z",
"spacegroup": 225
},
{
"id": "mp-865977",
"created_at": "2022-09-04T14:41:24.015727Z",
"structure_string": "Lu1 Cd1 Ag2\n1.0\n0.000000 3.462352 3.462352\n3.462352 0.000000 3.462352\n3.462352 3.462352 0.000000\nLu Cd Ag\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Lu\n0.500000 0.500000 0.500000 Cd\n0.250000 0.250000 0.250000 Ag\n0.750000 0.750000 0.750000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Lu",
"Cd",
"Ag"
],
"chemical_system": "Ag-Cd-Lu",
"density": 10.064036300157596,
"density_atomic": 0.04818549676514379,
"volume": 83.01253008754912,
"volume_molar": 12.4978285257739,
"formula_full": "Lu1 Cd1 Ag2",
"formula_reduced": "LuCdAg2",
"formula_anonymous": "ABC2",
"energy": -12.20220704,
"energy_per_atom": -3.05055176,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -12.20220704,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002127,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:21.433000Z",
"spacegroup": 225
},
{
"id": "mp-1222139",
"created_at": "2022-09-04T14:46:42.600414Z",
"structure_string": "Mg4 Cd1 Ag5\n1.0\n3.273287 0.000000 0.000000\n0.000000 3.273287 0.000000\n0.000000 0.000000 17.530459\nMg Cd Ag\n4 1 5\ndirect\n0.500000 0.500000 0.200268 Mg\n0.500000 0.500000 0.400267 Mg\n0.500000 0.500000 0.599733 Mg\n0.500000 0.500000 0.799732 Mg\n0.500000 0.500000 0.000000 Cd\n0.000000 0.000000 0.896344 Ag\n0.000000 0.000000 0.103656 Ag\n0.000000 0.000000 0.299853 Ag\n0.000000 0.000000 0.500000 Ag\n0.000000 0.000000 0.700147 Ag\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Mg",
"Cd",
"Ag"
],
"chemical_system": "Ag-Cd-Mg",
"density": 6.621451781912695,
"density_atomic": 0.05324006061643309,
"volume": 187.82848637316158,
"volume_molar": 11.311295836769208,
"formula_full": "Mg4 Cd1 Ag5",
"formula_reduced": "Mg4CdAg5",
"formula_anonymous": "AB4C5",
"energy": -23.67841873,
"energy_per_atom": -2.367841873,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -23.67841873,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0002605,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:41.233000Z",
"spacegroup": 123
}
]
}