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_anonymous&page=512",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=510",
"results": [
{
"id": "jvasp-107884",
"created_at": "2022-09-04T14:35:55.658915Z",
"updated_at": "2022-09-04T14:35:55.658942Z",
"structure_string": "Zn1 Ga1 Cu3 Se4\n1.0\n5.758491 0.000000 0.000000\n0.000000 5.758491 0.000000\n0.000000 0.000000 5.758491\nZn Ga Cu Se\n1 1 3 4\ndirect\n0.500000 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Ga\n-0.000000 0.500000 -0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.500000 0.000000 -0.000000 Cu\n0.252401 0.252401 0.252401 Se\n0.747599 0.747599 0.252401 Se\n0.252401 0.747599 0.747599 Se\n0.747599 0.252401 0.747599 Se\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Zn",
"Ga",
"Cu",
"Se"
],
"chemical_system": "Cu-Ga-Se-Zn",
"density": 5.579485385825565,
"density_atomic": 0.04713206112135793,
"volume": 190.95282034932362,
"volume_molar": 12.777164029584657,
"formula_full": "Zn1 Ga1 Cu3 Se4",
"formula_reduced": "ZnGaCu3Se4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 0.2762197268518517,
"spacegroup": 215
},
{
"id": "jvasp-57409",
"created_at": "2022-09-04T14:38:33.381151Z",
"updated_at": "2022-09-04T14:38:33.381177Z",
"structure_string": "Cr2 Ag6 Cl2 O8\n1.0\n5.305908 0.000000 0.000000\n0.000000 7.364233 0.000000\n0.000000 0.000000 7.364171\nCr Ag Cl O\n2 6 2 8\ndirect\n0.999978 0.000000 0.000000 Cr\n0.000022 0.500000 0.500000 Cr\n0.109104 0.500000 0.000000 Ag\n0.500000 0.750000 0.250000 Ag\n0.500000 0.250000 0.250000 Ag\n0.890897 0.000000 0.500000 Ag\n0.500000 0.250000 0.750000 Ag\n0.500000 0.750000 0.750000 Ag\n0.635679 0.500000 0.000000 Cl\n0.364321 0.000000 0.500000 Cl\n0.189489 0.816958 0.000000 O\n0.189548 0.500000 0.683037 O\n0.189489 0.183041 0.000000 O\n0.189548 0.500000 0.316963 O\n0.810453 0.000000 0.183037 O\n0.810511 0.683041 0.500000 O\n0.810511 0.316959 0.500000 O\n0.810453 0.000000 0.816963 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Cr",
"Ag",
"Cl",
"O"
],
"chemical_system": "Ag-Cl-Cr-O",
"density": 5.482876999845482,
"density_atomic": 0.06255491010512312,
"volume": 287.7471963392021,
"volume_molar": 9.626967331389066,
"formula_full": "Cr2 Ag6 Cl2 O8",
"formula_reduced": "CrAg3ClO4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 1.6889352497222228,
"spacegroup": 129
},
{
"id": "jvasp-24241",
"created_at": "2022-09-04T14:38:32.418633Z",
"updated_at": "2022-09-04T14:38:32.418650Z",
"structure_string": "K2 Li6 Pb2 O8\n1.0\n-5.945894 0.011567 -0.008287\n-0.178532 -5.976161 0.032738\n2.154909 1.967301 6.315576\nK Li Pb O\n2 6 2 8\ndirect\n0.510631 0.990885 0.250460 K\n0.489368 0.009115 0.749540 K\n0.051394 0.126934 0.906605 Li\n0.948605 0.873066 0.093395 Li\n0.681883 0.459196 0.153802 Li\n0.064498 0.165351 0.447043 Li\n0.935501 0.834649 0.552957 Li\n0.318116 0.540804 0.846199 Li\n0.241314 0.494525 0.295033 Pb\n0.758685 0.505475 0.704968 Pb\n0.359504 0.361582 0.566709 O\n0.879754 0.168000 0.633405 O\n0.120245 0.832000 0.366595 O\n0.656097 0.673791 0.973183 O\n0.343902 0.326209 0.026818 O\n0.065461 0.769228 0.835324 O\n0.934538 0.230772 0.164676 O\n0.640495 0.638418 0.433292 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"K",
"Li",
"Pb",
"O"
],
"chemical_system": "K-Li-O-Pb",
"density": 4.893775042350554,
"density_atomic": 0.08010385981197415,
"volume": 224.7082730126983,
"volume_molar": 7.51791583343877,
"formula_full": "K2 Li6 Pb2 O8",
"formula_reduced": "KLi3PbO4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 1.2604636466666663,
"spacegroup": 2
},
{
"id": "jvasp-110950",
"created_at": "2022-09-04T14:38:37.388250Z",
"updated_at": "2022-09-04T14:38:37.388264Z",
"structure_string": "Zn1 In3 As1 Se4\n1.0\n5.357339 -0.008737 2.391064\n2.645693 6.561758 1.225675\n-0.006884 -0.007961 7.218725\nZn In As Se\n1 3 1 4\ndirect\n0.978844 0.009681 0.002028 Zn\n0.401141 0.392016 0.804956 In\n0.613808 0.598803 0.194922 In\n0.807308 0.802148 0.597876 In\n0.421076 0.719609 0.904750 As\n0.622309 0.930838 0.300695 Se\n0.891923 0.108494 0.680971 Se\n0.062131 0.273176 0.126516 Se\n0.251464 0.465234 0.487283 Se\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Zn",
"In",
"As",
"Se"
],
"chemical_system": "As-In-Se-Zn",
"density": 5.233287963215026,
"density_atomic": 0.0354273864264065,
"volume": 254.04075512868408,
"volume_molar": 16.998546512906973,
"formula_full": "Zn1 In3 As1 Se4",
"formula_reduced": "ZnIn3AsSe4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 0.577849502962963,
"spacegroup": 1
},
{
"id": "jvasp-111243",
"created_at": "2022-09-04T14:38:46.224302Z",
"updated_at": "2022-09-04T14:38:46.224324Z",
"structure_string": "Al1 Cd1 Cu3 Se4\n1.0\n5.860010 0.000000 0.000000\n0.000000 5.860010 0.000000\n-0.000000 -0.000000 5.860010\nAl Cd Cu Se\n1 1 3 4\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 Cd\n-0.000000 0.500000 -0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.500000 0.000000 -0.000000 Cu\n0.238422 0.238422 0.238422 Se\n0.761578 0.761578 0.238422 Se\n0.238422 0.761578 0.761578 Se\n0.761578 0.238422 0.761578 Se\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Al",
"Cd",
"Cu",
"Se"
],
"chemical_system": "Al-Cd-Cu-Se",
"density": 5.329659952736813,
"density_atomic": 0.044724700196236734,
"volume": 201.23108618975797,
"volume_molar": 13.464910292471274,
"formula_full": "Al1 Cd1 Cu3 Se4",
"formula_reduced": "AlCdCu3Se4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 0.5031908185185182,
"spacegroup": 215
},
{
"id": "jvasp-110329",
"created_at": "2022-09-04T14:38:38.810344Z",
"updated_at": "2022-09-04T14:38:38.810360Z",
"structure_string": "Ga1 Cu3 Hg1 Se4\n1.0\n5.940182 -0.000000 0.000000\n0.000000 5.940182 0.000000\n-0.000000 -0.000000 5.940182\nGa Cu Hg Se\n1 3 1 4\ndirect\n0.000000 0.000000 0.000000 Ga\n0.000000 0.500000 0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.500000 0.000000 0.000000 Cu\n0.500000 0.500000 0.500000 Hg\n0.238171 0.238171 0.238171 Se\n0.761829 0.761829 0.238171 Se\n0.238171 0.761829 0.761829 Se\n0.761829 0.238171 0.761829 Se\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Ga",
"Cu",
"Hg",
"Se"
],
"chemical_system": "Cu-Ga-Hg-Se",
"density": 6.153950920056448,
"density_atomic": 0.04293814271170329,
"volume": 209.6038494358757,
"volume_molar": 14.025154279341002,
"formula_full": "Ga1 Cu3 Hg1 Se4",
"formula_reduced": "GaCu3HgSe4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 0.2784813046296294,
"spacegroup": 215
},
{
"id": "jvasp-104548",
"created_at": "2022-09-04T14:36:50.233559Z",
"updated_at": "2022-09-04T14:36:50.233575Z",
"structure_string": "Cd1 Cu3 Ni1 Se4\n1.0\n5.776183 0.000000 0.000000\n0.000000 5.776183 0.000000\n-0.000000 0.000000 5.776183\nCd Cu Ni Se\n1 3 1 4\ndirect\n0.500000 0.500000 0.500000 Cd\n-0.000000 0.500000 -0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.500000 0.000000 -0.000000 Cu\n0.000000 0.000000 0.000000 Ni\n0.235616 0.235616 0.235616 Se\n0.764384 0.764384 0.235616 Se\n0.235616 0.764384 0.764384 Se\n0.764384 0.235616 0.764384 Se\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Cd",
"Cu",
"Ni",
"Se"
],
"chemical_system": "Cd-Cu-Ni-Se",
"density": 5.838326548135368,
"density_atomic": 0.046700300744351886,
"volume": 192.71824499092747,
"volume_molar": 12.895293315061446,
"formula_full": "Cd1 Cu3 Ni1 Se4",
"formula_reduced": "CdCu3NiSe4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 0.4329418851851849,
"spacegroup": 215
},
{
"id": "jvasp-104547",
"created_at": "2022-09-04T14:36:45.073894Z",
"updated_at": "2022-09-04T14:36:45.073922Z",
"structure_string": "Mg1 Co1 Cu3 Se4\n1.0\n5.715249 -0.000000 0.000000\n0.000000 5.715249 0.000000\n-0.000000 -0.000000 5.715249\nMg Co Cu Se\n1 1 3 4\ndirect\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Co\n-0.000000 0.500000 -0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.500000 0.000000 -0.000000 Cu\n0.242747 0.242747 0.242747 Se\n0.757253 0.757253 0.242747 Se\n0.242747 0.757253 0.757253 Se\n0.757253 0.242747 0.757253 Se\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Mg",
"Co",
"Cu",
"Se"
],
"chemical_system": "Co-Cu-Mg-Se",
"density": 5.245497485151965,
"density_atomic": 0.04820998989260402,
"volume": 186.68329987309758,
"volume_molar": 12.49147899307871,
"formula_full": "Mg1 Co1 Cu3 Se4",
"formula_reduced": "MgCoCu3Se4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 0.8513316407407407,
"spacegroup": 215
},
{
"id": "jvasp-107156",
"created_at": "2022-09-04T14:36:56.337589Z",
"updated_at": "2022-09-04T14:36:56.337610Z",
"structure_string": "Cd1 Ga1 Cu3 Se4\n1.0\n5.901110 0.000000 0.000000\n0.000000 5.901110 0.000000\n-0.000000 -0.000000 5.901110\nCd Ga Cu Se\n1 1 3 4\ndirect\n0.500000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 Ga\n-0.000000 0.500000 -0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.500000 0.000000 -0.000000 Cu\n0.241082 0.241082 0.241082 Se\n0.758918 0.758918 0.241082 Se\n0.241082 0.758918 0.758918 Se\n0.758918 0.241082 0.758918 Se\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Cd",
"Ga",
"Cu",
"Se"
],
"chemical_system": "Cd-Cu-Ga-Se",
"density": 5.564453960202115,
"density_atomic": 0.0437966990282063,
"volume": 205.49493910953763,
"volume_molar": 13.750216097614052,
"formula_full": "Cd1 Ga1 Cu3 Se4",
"formula_reduced": "CdGaCu3Se4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 0.2373696546296293,
"spacegroup": 215
},
{
"id": "jvasp-104833",
"created_at": "2022-09-04T14:36:43.847964Z",
"updated_at": "2022-09-04T14:36:43.847981Z",
"structure_string": "Cr1 Cu3 Hg1 Se4\n1.0\n5.919983 0.000000 0.000000\n0.000000 5.919983 0.000000\n-0.000000 -0.000000 5.919983\nCr Cu Hg Se\n1 3 1 4\ndirect\n0.000000 0.000000 0.000000 Cr\n-0.000000 0.500000 -0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.500000 0.000000 -0.000000 Cu\n0.500000 0.500000 0.500000 Hg\n0.226074 0.226074 0.226074 Se\n0.773926 0.773926 0.226074 Se\n0.226074 0.773926 0.773926 Se\n0.773926 0.226074 0.773926 Se\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Cr",
"Cu",
"Hg",
"Se"
],
"chemical_system": "Cr-Cu-Hg-Se",
"density": 6.075278208494171,
"density_atomic": 0.04337915926510071,
"volume": 207.47290063873268,
"volume_molar": 13.882566794799358,
"formula_full": "Cr1 Cu3 Hg1 Se4",
"formula_reduced": "CrCu3HgSe4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 0.9598485351851856,
"spacegroup": 215
},
{
"id": "jvasp-104830",
"created_at": "2022-09-04T14:36:56.128607Z",
"updated_at": "2022-09-04T14:36:56.128629Z",
"structure_string": "V1 Cd1 Cu3 Se4\n1.0\n5.878787 0.000000 0.000000\n0.000000 5.878787 0.000000\n0.000000 -0.000000 5.878787\nV Cd Cu Se\n1 1 3 4\ndirect\n0.000000 0.000000 0.000000 V\n0.500000 0.500000 0.500000 Cd\n-0.000000 0.500000 -0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.500000 0.000000 -0.000000 Cu\n0.232454 0.232454 0.232454 Se\n0.767547 0.767547 0.232454 Se\n0.232454 0.767547 0.767547 Se\n0.767547 0.232454 0.767547 Se\n",
"nsites": 9,
"nelements": 4,
"elements": [
"V",
"Cd",
"Cu",
"Se"
],
"chemical_system": "Cd-Cu-Se-V",
"density": 5.474580433060918,
"density_atomic": 0.04429751195728635,
"volume": 203.1716817115644,
"volume_molar": 13.594760730143983,
"formula_full": "V1 Cd1 Cu3 Se4",
"formula_reduced": "VCdCu3Se4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 0.8570509740740739,
"spacegroup": 215
},
{
"id": "jvasp-10722",
"created_at": "2022-09-04T14:37:51.786219Z",
"updated_at": "2022-09-04T14:37:51.786242Z",
"structure_string": "Al8 C2 N6 O2\n1.0\n5.373088 0.048556 0.000000\n-1.975279 4.997070 -0.000000\n0.000000 0.000000 8.983015\nAl C N O\n8 2 6 2\ndirect\n0.594616 0.405385 0.592424 Al\n0.957854 0.042147 0.675595 Al\n0.042147 0.957854 0.175595 Al\n0.542021 0.899437 0.391621 Al\n0.100564 0.457980 0.391621 Al\n0.457980 0.100564 0.891621 Al\n0.899437 0.542021 0.891621 Al\n0.405384 0.594616 0.092423 Al\n0.195372 0.804628 0.004301 C\n0.804628 0.195373 0.504302 C\n0.825500 0.174501 0.839196 N\n0.836067 0.673272 0.706367 N\n0.174501 0.825499 0.339195 N\n0.326729 0.163934 0.706367 N\n0.673271 0.836067 0.206367 N\n0.163933 0.326729 0.206367 N\n0.568693 0.431308 0.978031 O\n0.431308 0.568693 0.478031 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Al",
"C",
"N",
"O"
],
"chemical_system": "Al-C-N-O",
"density": 2.4416447330502287,
"density_atomic": 0.07436393879105122,
"volume": 242.0528053331957,
"volume_molar": 8.098200361496573,
"formula_full": "Al8 C2 N6 O2",
"formula_reduced": "Al4CN3O",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 3.937798272222223,
"spacegroup": 36
}
]
}