HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=102",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=100",
"results": [
{
"id": "jvasp-18748",
"created_at": "2022-09-04T14:36:13.238282Z",
"updated_at": "2022-09-04T14:36:13.238310Z",
"structure_string": "Sn2 Mo6\n1.0\n5.120667 -0.000000 -0.000000\n0.000000 5.120667 -0.000000\n0.000000 0.000000 5.120667\nSn Mo\n2 6\ndirect\n0.000000 0.000000 0.000000 Sn\n0.500000 0.500000 0.500000 Sn\n0.250000 0.000000 0.500000 Mo\n0.750000 0.000000 0.500000 Mo\n0.000000 0.500000 0.250000 Mo\n0.000000 0.500000 0.750000 Mo\n0.500000 0.750000 0.000000 Mo\n0.500000 0.250000 0.000000 Mo\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sn",
"Mo"
],
"chemical_system": "Mo-Sn",
"density": 10.055231879959821,
"density_atomic": 0.05958135613753834,
"volume": 134.2701898481918,
"volume_molar": 10.107424789221675,
"formula_full": "Sn2 Mo6",
"formula_reduced": "SnMo3",
"formula_anonymous": "AB3",
"energy_above_hull": 4.61041735,
"spacegroup": 223
},
{
"id": "jvasp-91872",
"created_at": "2022-09-04T14:36:13.261129Z",
"updated_at": "2022-09-04T14:36:13.261158Z",
"structure_string": "Mg7 W1\n1.0\n6.182162 0.000000 0.000000\n-3.091081 5.353909 -0.000000\n-0.000000 0.000000 4.916773\nMg W\n7 1\ndirect\n0.169299 0.834649 0.250000 Mg\n0.665351 0.330701 0.250000 Mg\n0.665351 0.834649 0.250000 Mg\n0.322306 0.177694 0.749999 Mg\n0.322306 0.644614 0.749999 Mg\n0.855386 0.177694 0.749999 Mg\n0.833333 0.666667 0.749999 Mg\n0.166667 0.333333 0.250000 W\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mg",
"W"
],
"chemical_system": "Mg-W",
"density": 3.6118538050472773,
"density_atomic": 0.049158481872568424,
"volume": 162.7389556239365,
"volume_molar": 12.25046122378424,
"formula_full": "Mg7 W1",
"formula_reduced": "Mg7W",
"formula_anonymous": "AB7",
"energy_above_hull": 0.3155691687499999,
"spacegroup": 187
},
{
"id": "jvasp-15003",
"created_at": "2022-09-04T14:36:11.176363Z",
"updated_at": "2022-09-04T14:36:11.176399Z",
"structure_string": "Nb6 Pt2\n1.0\n5.205701 0.000000 0.000000\n-0.000000 5.205701 0.000000\n-0.000000 0.000000 5.205701\nNb Pt\n6 2\ndirect\n0.250000 0.000000 0.500000 Nb\n0.750000 0.000000 0.500000 Nb\n0.000000 0.500000 0.250000 Nb\n0.000000 0.500000 0.750000 Nb\n0.500000 0.750000 0.000000 Nb\n0.500000 0.250000 0.000000 Nb\n0.000000 0.000000 0.000000 Pt\n0.500000 0.500000 0.500000 Pt\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Nb",
"Pt"
],
"chemical_system": "Nb-Pt",
"density": 11.154224159215667,
"density_atomic": 0.05670904416429382,
"volume": 141.0709723271461,
"volume_molar": 10.619365656301731,
"formula_full": "Nb6 Pt2",
"formula_reduced": "Nb3Pt",
"formula_anonymous": "AB3",
"energy_above_hull": 4.6717524,
"spacegroup": 223
},
{
"id": "jvasp-96101",
"created_at": "2022-09-04T14:35:46.700451Z",
"updated_at": "2022-09-04T14:35:46.700481Z",
"structure_string": "Si16 O32\n1.0\n4.346962 0.000000 0.000000\n-0.000000 12.349254 -0.000000\n0.000000 -0.000000 12.349254\nSi O\n16 32\ndirect\n0.741775 0.854693 0.522051 Si\n0.741775 0.022051 0.354693 Si\n0.258224 0.354693 0.022051 Si\n0.258224 0.854693 0.977949 Si\n0.258224 0.522051 0.854693 Si\n0.741775 0.145307 0.022051 Si\n0.741775 0.477949 0.145307 Si\n0.741775 0.645307 0.977949 Si\n0.741775 0.522051 0.645307 Si\n0.258224 0.977949 0.645307 Si\n0.741775 0.354693 0.477949 Si\n0.258224 0.145307 0.477949 Si\n0.258224 0.022051 0.145307 Si\n0.258224 0.645307 0.522051 Si\n0.258224 0.477949 0.354693 Si\n0.741775 0.977949 0.854693 Si\n0.124980 0.095736 0.595736 O\n0.124980 0.404264 0.904263 O\n0.500000 0.250000 0.498696 O\n0.000000 0.125474 0.125474 O\n0.500000 0.498696 0.250000 O\n0.000000 0.625474 0.874526 O\n0.875020 0.595736 0.095736 O\n0.500000 0.437589 0.062411 O\n0.124980 0.595736 0.404264 O\n0.875020 0.904263 0.404264 O\n0.000000 0.125474 0.374526 O\n0.500000 0.437589 0.437589 O\n0.500000 0.937589 0.562411 O\n0.875020 0.095736 0.904263 O\n0.000000 0.374526 0.374526 O\n0.500000 0.750000 0.501304 O\n0.500000 0.501304 0.750000 O\n0.500000 0.562411 0.937589 O\n0.500000 0.062411 0.437589 O\n0.000000 0.374526 0.125474 O\n0.500000 0.250000 0.001304 O\n0.500000 0.937589 0.937589 O\n0.000000 0.874526 0.625474 O\n0.000000 0.625474 0.625474 O\n0.500000 0.001304 0.250000 O\n0.500000 0.998696 0.750000 O\n0.500000 0.062411 0.062411 O\n0.500000 0.562411 0.562411 O\n0.000000 0.874526 0.874526 O\n0.124980 0.904263 0.095736 O\n0.500000 0.750000 0.998696 O\n0.875020 0.404264 0.595736 O\n",
"nsites": 48,
"nelements": 2,
"elements": [
"Si",
"O"
],
"chemical_system": "O-Si",
"density": 2.4080350039156575,
"density_atomic": 0.07240589848062802,
"volume": 662.9294160729496,
"volume_molar": 8.317196369866476,
"formula_full": "Si16 O32",
"formula_reduced": "SiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.5598952,
"spacegroup": 125
},
{
"id": "jvasp-601",
"created_at": "2022-09-04T14:36:11.122936Z",
"updated_at": "2022-09-04T14:36:11.122949Z",
"structure_string": "Te2 Rh1\n1.0\n1.977626 -3.425349 -0.000000\n1.977626 3.425349 0.000000\n0.000000 0.000000 5.507526\nTe Rh\n2 1\ndirect\n0.666668 0.333334 0.746732 Te\n0.333334 0.666668 0.253269 Te\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Te",
"Rh"
],
"chemical_system": "Rh-Te",
"density": 7.969380202261169,
"density_atomic": 0.0402055227003433,
"volume": 74.61661479591669,
"volume_molar": 14.9783919111903,
"formula_full": "Te2 Rh1",
"formula_reduced": "Te2Rh",
"formula_anonymous": "AB2",
"energy_above_hull": 1.273346177777778,
"spacegroup": 164
},
{
"id": "jvasp-93674",
"created_at": "2022-09-04T14:36:11.263840Z",
"updated_at": "2022-09-04T14:36:11.263862Z",
"structure_string": "Hf2 Fe4\n1.0\n-3.473887 -3.473887 -0.000000\n-3.473887 0.000000 -3.473887\n0.000000 -3.473887 -3.473887\nHf Fe\n2 4\ndirect\n0.125000 0.125000 0.125000 Hf\n0.875001 0.875001 0.875001 Hf\n0.500000 0.500000 0.000000 Fe\n0.500000 0.000000 0.500000 Fe\n0.000000 0.500000 0.500000 Fe\n0.500000 0.500000 0.500000 Fe\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Hf",
"Fe"
],
"chemical_system": "Fe-Hf",
"density": 11.493955503802633,
"density_atomic": 0.07156063611240938,
"volume": 83.84497855182615,
"volume_molar": 8.415437714304632,
"formula_full": "Hf2 Fe4",
"formula_reduced": "HfFe2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.5327846666666662,
"spacegroup": 227
},
{
"id": "jvasp-2160",
"created_at": "2022-09-04T14:36:13.837493Z",
"updated_at": "2022-09-04T14:36:13.837507Z",
"structure_string": "Fe2 As4\n1.0\n2.911651 0.000000 0.000000\n0.000000 5.313396 0.000000\n0.000000 0.000000 6.006929\nFe As\n2 4\ndirect\n0.000000 0.000000 0.000000 Fe\n0.500000 0.500000 0.500000 Fe\n0.000000 0.179963 0.361331 As\n0.000000 0.820038 0.638670 As\n0.500000 0.679963 0.138669 As\n0.500000 0.320037 0.861331 As\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Fe",
"As"
],
"chemical_system": "As-Fe",
"density": 7.350628425872343,
"density_atomic": 0.06456352732488986,
"volume": 92.93172552062443,
"volume_molar": 9.327465535914744,
"formula_full": "Fe2 As4",
"formula_reduced": "FeAs2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.3032163333333333,
"spacegroup": 58
},
{
"id": "jvasp-85867",
"created_at": "2022-09-04T14:36:14.244809Z",
"updated_at": "2022-09-04T14:36:14.244829Z",
"structure_string": "Th4 Ag2\n1.0\n-0.000000 0.000000 -5.868260\n-3.807707 3.807707 -2.934130\n3.807707 3.807707 -2.934130\nTh Ag\n4 2\ndirect\n0.343917 0.500000 0.812164 Th\n0.656082 0.500000 0.187837 Th\n0.843917 0.812164 0.500000 Th\n0.156082 0.187837 0.500000 Th\n0.750000 0.000000 0.000000 Ag\n0.250000 0.000000 0.000000 Ag\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Th",
"Ag"
],
"chemical_system": "Ag-Th",
"density": 11.162628118949428,
"density_atomic": 0.035260207395928826,
"volume": 170.16349145730678,
"volume_molar": 17.07914162948265,
"formula_full": "Th4 Ag2",
"formula_reduced": "Th2Ag",
"formula_anonymous": "AB2",
"energy_above_hull": 1.8867528200000003,
"spacegroup": 140
},
{
"id": "jvasp-93248",
"created_at": "2022-09-04T14:36:14.277342Z",
"updated_at": "2022-09-04T14:36:14.277358Z",
"structure_string": "Ni4 O1\n1.0\n3.771015 -0.000000 -0.000000\n0.000000 3.771015 -0.000000\n0.000000 0.000000 3.771015\nNi O\n4 1\ndirect\n0.000000 0.000000 0.000000 Ni\n0.500001 0.500001 0.000000 Ni\n0.500001 0.000000 0.500001 Ni\n0.000000 0.500001 0.500001 Ni\n0.500001 0.500000 0.500001 O\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Ni",
"O"
],
"chemical_system": "Ni-O",
"density": 7.765243758428576,
"density_atomic": 0.09323848852374209,
"volume": 53.62592293339042,
"volume_molar": 6.4588571257957845,
"formula_full": "Ni4 O1",
"formula_reduced": "Ni4O",
"formula_anonymous": "AB4",
"energy_above_hull": 1.37932262,
"spacegroup": 221
},
{
"id": "jvasp-54949",
"created_at": "2022-09-04T14:36:14.290329Z",
"updated_at": "2022-09-04T14:36:14.290357Z",
"structure_string": "Co4 Sn2\n1.0\n2.147795 -3.720091 -0.000000\n2.147795 3.720091 0.000000\n0.000000 0.000000 5.210733\nCo Sn\n4 2\ndirect\n0.333332 0.666666 0.250000 Co\n0.000000 0.000000 0.000000 Co\n0.000000 0.000000 0.500000 Co\n0.666666 0.333332 0.750000 Co\n0.666666 0.333332 0.250000 Sn\n0.333332 0.666666 0.750000 Sn\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Co",
"Sn"
],
"chemical_system": "Co-Sn",
"density": 9.435725258245679,
"density_atomic": 0.07205697791416939,
"volume": 83.26743881969205,
"volume_molar": 8.357470621614562,
"formula_full": "Co4 Sn2",
"formula_reduced": "Co2Sn",
"formula_anonymous": "AB2",
"energy_above_hull": 2.121431166666667,
"spacegroup": 194
},
{
"id": "jvasp-106069",
"created_at": "2022-09-04T14:36:14.398386Z",
"updated_at": "2022-09-04T14:36:14.398416Z",
"structure_string": "Hf3 N2\n1.0\n3.148633 0.000743 7.350998\n1.508659 2.763665 7.350998\n0.001251 0.000743 7.996942\nHf N\n3 2\ndirect\n0.779567 0.779568 0.779569 Hf\n0.220432 0.220432 0.220432 Hf\n0.000000 0.000000 0.000000 Hf\n0.611690 0.611691 0.611692 N\n0.388309 0.388309 0.388310 N\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Hf",
"N"
],
"chemical_system": "Hf-N",
"density": 13.454554994401098,
"density_atomic": 0.07189672674247813,
"volume": 69.544195216413,
"volume_molar": 8.376098652683156,
"formula_full": "Hf3 N2",
"formula_reduced": "Hf3N2",
"formula_anonymous": "A2B3",
"energy_above_hull": 5.3772951,
"spacegroup": 166
},
{
"id": "jvasp-93722",
"created_at": "2022-09-04T14:36:14.424150Z",
"updated_at": "2022-09-04T14:36:14.424164Z",
"structure_string": "Ce2 Mg4\n1.0\n5.751579 0.000000 -0.000000\n-2.875790 4.981014 0.000000\n-0.000000 0.000000 5.377320\nCe Mg\n2 4\ndirect\n0.666667 0.333333 0.500000 Ce\n0.333333 0.666666 0.500000 Ce\n0.684729 0.999999 0.000000 Mg\n0.315270 0.315270 0.000000 Mg\n-0.000000 0.684729 0.000000 Mg\n0.000000 0.000000 0.500000 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ce",
"Mg"
],
"chemical_system": "Ce-Mg",
"density": 4.068554096474691,
"density_atomic": 0.038947583481521955,
"volume": 154.05320339955372,
"volume_molar": 15.462167923350385,
"formula_full": "Ce2 Mg4",
"formula_reduced": "CeMg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.5890051190476191,
"spacegroup": 189
}
]
}