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=formula_full&page=1155",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_full&page=1153",
"results": [
{
"id": "jvasp-79283",
"created_at": "2022-09-04T14:37:18.528155Z",
"updated_at": "2022-09-04T14:37:18.528183Z",
"structure_string": "Cu2 Te2\n1.0\n3.897587 -0.000000 0.000000\n0.000000 3.890762 0.000000\n0.000000 0.000000 5.510907\nCu Te\n2 2\ndirect\n0.750001 0.749562 0.250000 Cu\n0.250000 0.250437 0.750000 Cu\n0.250000 0.249698 0.250000 Te\n0.750001 0.750301 0.750000 Te\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cu",
"Te"
],
"chemical_system": "Cu-Te",
"density": 7.596101192078944,
"density_atomic": 0.04786371739059319,
"volume": 83.57060876316584,
"volume_molar": 12.581849234266855,
"formula_full": "Cu2 Te2",
"formula_reduced": "CuTe",
"formula_anonymous": "AB",
"energy_above_hull": 0.1740741083333333,
"spacegroup": 225
},
{
"id": "jvasp-22592",
"created_at": "2022-09-04T14:35:57.316455Z",
"updated_at": "2022-09-04T14:35:57.316472Z",
"structure_string": "Cu2 W1 S4\n1.0\n4.926178 0.000000 -2.343058\n-1.114438 4.798465 -2.343058\n0.011155 0.014043 6.373521\nCu W S\n2 1 4\ndirect\n0.500000 -0.000000 -0.000000 Cu\n-0.000000 0.500000 -0.000000 Cu\n0.000000 0.000000 0.000000 W\n0.891988 0.891986 0.257946 S\n0.365960 0.365960 0.257947 S\n0.108013 0.634039 0.742052 S\n0.634041 0.108012 0.742052 S\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Cu",
"W",
"S"
],
"chemical_system": "Cu-S-W",
"density": 4.830345402224473,
"density_atomic": 0.04636312582917492,
"volume": 150.98205469992513,
"volume_molar": 12.989074080528122,
"formula_full": "Cu2 W1 S4",
"formula_reduced": "Cu2WS4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.323195842857143,
"spacegroup": 121
},
{
"id": "jvasp-8190",
"created_at": "2022-09-04T14:37:04.062644Z",
"updated_at": "2022-09-04T14:37:04.062671Z",
"structure_string": "Cu2 W1 S4\n1.0\n5.438402 0.000000 0.000000\n0.000000 5.438402 0.000000\n0.000000 0.000000 5.204994\nCu W S\n2 1 4\ndirect\n0.000000 0.500000 0.000000 Cu\n0.500000 0.000000 0.000000 Cu\n0.000000 0.000000 0.000000 W\n0.237696 0.762303 0.251767 S\n0.762303 0.762303 0.748232 S\n0.237696 0.237696 0.748232 S\n0.762303 0.237696 0.251767 S\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Cu",
"W",
"S"
],
"chemical_system": "Cu-S-W",
"density": 4.737406712409885,
"density_atomic": 0.0454710719879966,
"volume": 153.94402845501094,
"volume_molar": 13.24389440739316,
"formula_full": "Cu2 W1 S4",
"formula_reduced": "Cu2WS4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.3238401285714283,
"spacegroup": 111
},
{
"id": "jvasp-35366",
"created_at": "2022-09-04T14:37:33.767211Z",
"updated_at": "2022-09-04T14:37:33.767237Z",
"structure_string": "Cu2 W1 Se4\n1.0\n5.560334 0.000000 0.000000\n0.000000 5.560334 -0.000000\n0.000000 -0.000000 5.372387\nCu W Se\n2 1 4\ndirect\n0.500000 0.000000 0.500000 Cu\n0.000000 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 W\n0.255112 0.744887 0.232711 Se\n0.744887 0.255112 0.232711 Se\n0.255112 0.255112 0.767290 Se\n0.744887 0.744887 0.767290 Se\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Cu",
"W",
"Se"
],
"chemical_system": "Cu-Se-W",
"density": 6.265989104057724,
"density_atomic": 0.042143343797763036,
"volume": 166.09977683763097,
"volume_molar": 14.289660518868592,
"formula_full": "Cu2 W1 Se4",
"formula_reduced": "Cu2WSe4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.032806338095238,
"spacegroup": 111
},
{
"id": "jvasp-28436",
"created_at": "2022-09-04T14:37:07.774452Z",
"updated_at": "2022-09-04T14:37:07.774472Z",
"structure_string": "Cu2 W1 Se4\n1.0\n5.588831 -0.000000 0.000000\n-0.000000 5.588831 0.000000\n-2.794416 -2.794416 5.427381\nCu W Se\n2 1 4\ndirect\n-0.000000 0.500000 -0.000000 Cu\n0.500000 -0.000000 -0.000000 Cu\n0.000000 0.000000 0.000000 W\n0.373241 0.373241 0.263857 Se\n0.890616 0.890616 0.263857 Se\n0.109383 0.626758 0.736143 Se\n0.626758 0.109383 0.736143 Se\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Cu",
"W",
"Se"
],
"chemical_system": "Cu-Se-W",
"density": 6.139406927181724,
"density_atomic": 0.041291986396694486,
"volume": 169.52441892115817,
"volume_molar": 14.584284471434598,
"formula_full": "Cu2 W1 Se4",
"formula_reduced": "Cu2WSe4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.021684909523809,
"spacegroup": 121
},
{
"id": "jvasp-57358",
"created_at": "2022-09-04T14:38:17.734283Z",
"updated_at": "2022-09-04T14:38:17.734309Z",
"structure_string": "Cu2 W2 O6 F4\n1.0\n0.000000 3.733931 0.021676\n9.670615 0.000000 0.000000\n0.000000 -1.443131 -5.060031\nCu W O F\n2 2 6 4\ndirect\n0.000000 0.500000 0.500000 Cu\n0.000000 0.000000 0.500000 Cu\n0.784827 0.250000 0.968874 W\n0.215173 0.750000 0.031125 W\n0.124626 0.608341 0.808007 O\n0.875374 0.391659 0.191992 O\n0.875374 0.108341 0.191992 O\n0.255338 0.250000 0.888267 O\n0.744662 0.750000 0.111732 O\n0.124626 0.891660 0.808007 O\n0.345632 0.888733 0.357415 F\n0.654368 0.111267 0.642585 F\n0.654368 0.388733 0.642585 F\n0.345632 0.611267 0.357415 F\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Cu",
"W",
"O",
"F"
],
"chemical_system": "Cu-F-O-W",
"density": 6.069683102891614,
"density_atomic": 0.07674924404087778,
"volume": 182.41222014569152,
"volume_molar": 7.846514757581871,
"formula_full": "Cu2 W2 O6 F4",
"formula_reduced": "CuWO3F2",
"formula_anonymous": "ABC2D3",
"energy_above_hull": 2.0609530735714285,
"spacegroup": 11
},
{
"id": "jvasp-89267",
"created_at": "2022-09-04T14:35:55.627535Z",
"updated_at": "2022-09-04T14:35:55.627548Z",
"structure_string": "Cu2 W2 O8\n1.0\n4.673251 0.010122 0.579241\n0.199923 4.920028 0.167985\n-0.023090 0.029425 5.917594\nCu W O\n2 2 8\ndirect\n0.496195 0.752222 0.658377 Cu\n0.503804 0.247778 0.341623 Cu\n0.017436 0.746159 0.172358 W\n0.982564 0.253842 0.827642 W\n0.218961 0.054662 0.090354 O\n0.781038 0.945339 0.909646 O\n0.265287 0.094418 0.618962 O\n0.734712 0.905583 0.381038 O\n0.251701 0.571905 0.354043 O\n0.748298 0.428096 0.645957 O\n0.216773 0.570499 0.882226 O\n0.783226 0.429502 0.117774 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Cu",
"W",
"O"
],
"chemical_system": "Cu-O-W",
"density": 7.598610065590686,
"density_atomic": 0.08817400674503137,
"volume": 136.09452992989006,
"volume_molar": 6.829836799198591,
"formula_full": "Cu2 W2 O8",
"formula_reduced": "CuWO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.8763724083333337,
"spacegroup": 2
},
{
"id": "jvasp-104564",
"created_at": "2022-09-04T14:36:43.803985Z",
"updated_at": "2022-09-04T14:36:43.804002Z",
"structure_string": "Cu3 Ag1\n1.0\n3.434651 0.004440 -3.071233\n-0.684274 3.365802 -3.071233\n-0.003623 -0.004440 4.607526\nCu Ag\n3 1\ndirect\n0.750000 0.250000 0.500001 Cu\n0.250001 0.750000 0.500002 Cu\n0.500000 0.500000 0.000001 Cu\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cu",
"Ag"
],
"chemical_system": "Ag-Cu",
"density": 9.319932026380632,
"density_atomic": 0.07520908115930876,
"volume": 53.18506672787497,
"volume_molar": 8.007198954131391,
"formula_full": "Cu3 Ag1",
"formula_reduced": "Cu3Ag",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-112372",
"created_at": "2022-09-04T14:38:39.819363Z",
"updated_at": "2022-09-04T14:38:39.819382Z",
"structure_string": "Cu3 Ag3 P2 S8\n1.0\n6.310778 0.021687 0.030379\n0.031911 6.410882 0.046539\n0.016981 0.018002 7.720680\nCu Ag P S\n3 3 2 8\ndirect\n0.509241 0.681977 0.748974 Cu\n0.502968 0.701092 0.254774 Cu\n0.016563 0.325452 0.751546 Cu\n0.023803 0.310646 0.242925 Ag\n0.011265 0.842525 0.501367 Ag\n0.494419 0.137038 0.996406 Ag\n0.506737 0.187857 0.505361 P\n0.993422 0.813729 0.995622 P\n0.409454 0.871894 0.504701 S\n0.898388 0.124185 0.980170 S\n0.833719 0.203291 0.517474 S\n0.326908 0.775042 0.999465 S\n0.873055 0.655937 0.779329 S\n0.866449 0.682682 0.220997 S\n0.376043 0.342666 0.721882 S\n0.413567 0.343985 0.279008 S\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Cu",
"Ag",
"P",
"S"
],
"chemical_system": "Ag-Cu-P-S",
"density": 4.4269644450848675,
"density_atomic": 0.05122513060649071,
"volume": 312.3466901999982,
"volume_molar": 11.756223339403135,
"formula_full": "Cu3 Ag3 P2 S8",
"formula_reduced": "Cu3Ag3(PS4)2",
"formula_anonymous": "A2B3C3D8",
"energy_above_hull": 1.467070258125,
"spacegroup": 1
},
{
"id": "jvasp-101555",
"created_at": "2022-09-04T14:37:02.203087Z",
"updated_at": "2022-09-04T14:37:02.203114Z",
"structure_string": "Cu3 As1\n1.0\n3.751904 0.000000 0.000000\n0.000000 3.751904 0.000000\n0.000000 0.000000 3.751904\nCu As\n3 1\ndirect\n-0.000000 0.499999 0.499999 Cu\n0.499999 0.000000 0.499999 Cu\n0.499999 0.499999 -0.000000 Cu\n0.000000 0.000000 0.000000 As\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cu",
"As"
],
"chemical_system": "As-Cu",
"density": 8.349413131822102,
"density_atomic": 0.07573643153642542,
"volume": 52.81474079058241,
"volume_molar": 7.951445081095025,
"formula_full": "Cu3 As1",
"formula_reduced": "Cu3As",
"formula_anonymous": "AB3",
"energy_above_hull": 0.277953275,
"spacegroup": 221
},
{
"id": "jvasp-100446",
"created_at": "2022-09-04T14:37:01.405586Z",
"updated_at": "2022-09-04T14:37:01.405611Z",
"structure_string": "Cu3 As1\n1.0\n3.683621 -0.000000 2.126738\n1.227873 3.472951 2.126739\n-0.000000 0.000000 4.253479\nCu As\n3 1\ndirect\n0.500000 0.500000 0.500001 Cu\n0.250000 0.250000 0.250000 Cu\n0.749999 0.750000 0.750001 Cu\n0.000000 0.000000 0.000000 As\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cu",
"As"
],
"chemical_system": "As-Cu",
"density": 8.10388397013317,
"density_atomic": 0.07350926871062433,
"volume": 54.4149067207613,
"volume_molar": 8.192355692867364,
"formula_full": "Cu3 As1",
"formula_reduced": "Cu3As",
"formula_anonymous": "AB3",
"energy_above_hull": 0.302733275,
"spacegroup": 225
},
{
"id": "jvasp-17746",
"created_at": "2022-09-04T14:37:31.574209Z",
"updated_at": "2022-09-04T14:37:31.574229Z",
"structure_string": "Cu3 As1 S4\n1.0\n5.321207 -0.000000 0.000000\n-0.000000 5.321207 -0.000000\n-0.000000 0.000000 5.321207\nCu As S\n3 1 4\ndirect\n0.000000 0.500000 0.500000 Cu\n0.500000 0.500000 0.000000 Cu\n0.500000 0.000000 0.500000 Cu\n0.000000 0.000000 0.000000 As\n0.255448 0.744553 0.744553 S\n0.744553 0.744553 0.255448 S\n0.744553 0.255448 0.744553 S\n0.255448 0.255448 0.255448 S\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cu",
"As",
"S"
],
"chemical_system": "As-Cu-S",
"density": 4.3402621652755675,
"density_atomic": 0.05309572139857838,
"volume": 150.67127424346847,
"volume_molar": 11.342045274784121,
"formula_full": "Cu3 As1 S4",
"formula_reduced": "Cu3AsS4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 1.2250816375,
"spacegroup": 215
}
]
}