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=4140",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=4138",
"results": [
{
"id": "jvasp-9784",
"created_at": "2022-09-04T14:37:12.190794Z",
"updated_at": "2022-09-04T14:37:12.190811Z",
"structure_string": "Cd4 Ga2 Ag2 S8\n1.0\n6.679733 0.000000 0.000000\n0.000000 6.961780 0.000000\n0.000000 0.000000 8.189083\nCd Ga Ag S\n4 2 2 8\ndirect\n0.486435 0.175441 0.252610 Cd\n0.986434 0.824559 0.752609 Cd\n0.486435 0.175441 0.747390 Cd\n0.986434 0.824559 0.247390 Cd\n0.491122 0.676937 0.500000 Ga\n0.991122 0.323063 0.000000 Ga\n0.989857 0.341004 0.500000 Ag\n0.489858 0.658996 0.000000 Ag\n0.107936 0.634532 0.000000 S\n0.607936 0.365468 0.500000 S\n0.146462 0.677704 0.500000 S\n0.646461 0.322296 0.000000 S\n0.603756 0.824708 0.265588 S\n0.103757 0.175292 0.765588 S\n0.103757 0.175292 0.234411 S\n0.603756 0.824708 0.734411 S\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Cd",
"Ga",
"Ag",
"S"
],
"chemical_system": "Ag-Cd-Ga-S",
"density": 4.627981107456439,
"density_atomic": 0.04201509128157181,
"volume": 380.815547746239,
"volume_molar": 14.333280200777203,
"formula_full": "Cd4 Ga2 Ag2 S8",
"formula_reduced": "Cd2GaAgS4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.3707161356249999,
"spacegroup": 31
},
{
"id": "jvasp-34817",
"created_at": "2022-09-04T14:37:12.089956Z",
"updated_at": "2022-09-04T14:37:12.089977Z",
"structure_string": "Sr2 Ni1 N6 O12\n1.0\n6.105254 -0.000000 3.524870\n2.035084 5.756088 3.524870\n0.000000 0.000000 7.049740\nSr Ni N O\n2 1 6 12\ndirect\n0.250000 0.250001 0.250000 Sr\n0.749999 0.750001 0.750000 Sr\n0.000000 0.000000 0.000000 Ni\n0.202425 0.202425 0.797575 N\n0.202426 0.797575 0.797574 N\n0.797574 0.202425 0.202427 N\n0.797574 0.202425 0.797575 N\n0.202426 0.797575 0.202426 N\n0.797573 0.797575 0.202426 N\n0.607997 -0.000000 0.999999 O\n-0.000000 -0.000000 0.607998 O\n0.607997 -0.000000 0.392003 O\n0.392002 0.000000 0.000001 O\n0.392004 0.607997 0.000000 O\n0.999998 0.392003 0.607997 O\n-0.000000 0.607997 0.392004 O\n0.999998 0.392003 0.000001 O\n0.392002 -0.000000 0.607997 O\n0.607996 0.392003 0.000000 O\n-0.000000 -0.000000 0.392003 O\n-0.000000 0.607997 0.000000 O\n",
"nsites": 21,
"nelements": 4,
"elements": [
"Sr",
"Ni",
"N",
"O"
],
"chemical_system": "N-Ni-O-Sr",
"density": 3.418112861202708,
"density_atomic": 0.08476470069551521,
"volume": 247.74463695016718,
"volume_molar": 7.10453845832859,
"formula_full": "Sr2 Ni1 N6 O12",
"formula_reduced": "Sr2Ni(NO2)6",
"formula_anonymous": "AB2C6D12",
"energy_above_hull": 3.637732215238095,
"spacegroup": 225
},
{
"id": "jvasp-11187",
"created_at": "2022-09-04T14:37:12.132641Z",
"updated_at": "2022-09-04T14:37:12.132672Z",
"structure_string": "Rb4 Li2 As2 O8\n1.0\n5.832300 0.000000 -0.000000\n-2.916150 5.862124 -0.000000\n0.000000 -0.000000 7.909902\nRb Li As O\n4 2 2 8\ndirect\n0.057660 0.115320 0.848446 Rb\n0.942339 0.884680 0.348446 Rb\n0.603508 0.207016 0.498117 Rb\n0.396492 0.792983 0.998117 Rb\n0.796641 0.593280 0.768818 Li\n0.203359 0.406719 0.268818 Li\n0.688936 0.377871 0.055814 As\n0.311064 0.622128 0.555814 As\n0.402332 0.284393 0.161666 O\n0.597667 0.715606 0.661666 O\n0.633273 0.266547 0.852873 O\n0.366727 0.733452 0.352873 O\n0.882060 0.284393 0.161666 O\n0.117940 0.715606 0.661666 O\n0.164843 0.329686 0.523500 O\n0.835157 0.670314 0.023500 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Rb",
"Li",
"As",
"O"
],
"chemical_system": "As-Li-O-Rb",
"density": 3.890384710785744,
"density_atomic": 0.05916352261488318,
"volume": 270.4369059318831,
"volume_molar": 10.178806963879243,
"formula_full": "Rb4 Li2 As2 O8",
"formula_reduced": "Rb2LiAsO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.33058071875,
"spacegroup": 36
},
{
"id": "jvasp-9975",
"created_at": "2022-09-04T14:37:12.059257Z",
"updated_at": "2022-09-04T14:37:12.059280Z",
"structure_string": "K2 Ca1 C2 O6\n1.0\n4.920840 -0.038012 4.568141\n1.968720 4.510017 4.568141\n-0.058562 -0.038012 6.714101\nK Ca C O\n2 1 2 6\ndirect\n0.209554 0.209555 0.209554 K\n0.790445 0.790447 0.790445 K\n0.000000 0.000000 0.000000 Ca\n0.587337 0.587338 0.587336 C\n0.412663 0.412664 0.412662 C\n0.689573 0.274904 0.274903 O\n0.274904 0.274904 0.689572 O\n0.274903 0.689574 0.274903 O\n0.725096 0.310428 0.725096 O\n0.725096 0.725097 0.310426 O\n0.310427 0.725097 0.725095 O\n",
"nsites": 11,
"nelements": 4,
"elements": [
"K",
"Ca",
"C",
"O"
],
"chemical_system": "C-Ca-K-O",
"density": 2.6163603227126973,
"density_atomic": 0.072732907816069,
"volume": 151.23828168423304,
"volume_molar": 8.279802005481649,
"formula_full": "K2 Ca1 C2 O6",
"formula_reduced": "K2Ca(CO3)2",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 2.4697988563636364,
"spacegroup": 166
},
{
"id": "jvasp-57476",
"created_at": "2022-09-04T14:37:12.760746Z",
"updated_at": "2022-09-04T14:37:12.760779Z",
"structure_string": "Cu2 C2 S2 N2\n1.0\n1.904891 -3.299369 0.000000\n1.904891 3.299369 -0.000000\n0.000000 0.000000 11.016318\nCu C S N\n2 2 2 2\ndirect\n0.666667 0.333333 0.501673 Cu\n0.333333 0.666667 0.001673 Cu\n0.333333 0.666667 0.280135 C\n0.666667 0.333333 0.780135 C\n0.666667 0.333333 0.930793 S\n0.333333 0.666667 0.430793 S\n0.666667 0.333333 0.673599 N\n0.333333 0.666667 0.173598 N\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Cu",
"C",
"S",
"N"
],
"chemical_system": "C-Cu-N-S",
"density": 2.917068367413692,
"density_atomic": 0.0577726791478945,
"volume": 138.4737581499465,
"volume_molar": 10.423855789314688,
"formula_full": "Cu2 C2 S2 N2",
"formula_reduced": "CuCSN",
"formula_anonymous": "ABCD",
"energy_above_hull": 3.193158425,
"spacegroup": 186
},
{
"id": "jvasp-10969",
"created_at": "2022-09-04T14:37:12.043369Z",
"updated_at": "2022-09-04T14:37:12.043388Z",
"structure_string": "K2 Th2 Cu2 S6\n1.0\n4.085172 0.000000 0.000000\n-2.042586 6.850014 -0.000000\n0.000000 0.000000 10.569499\nK Th Cu S\n2 2 2 6\ndirect\n0.744033 0.488067 0.250000 K\n0.255965 0.511932 0.750000 K\n0.000000 0.000000 0.000000 Th\n0.000000 0.000000 0.500000 Th\n0.466742 0.933486 0.250000 Cu\n0.533256 0.066513 0.750000 Cu\n0.629415 0.258831 0.932799 S\n0.370583 0.741168 0.067201 S\n0.933667 0.867337 0.750000 S\n0.066331 0.132662 0.250000 S\n0.370583 0.741168 0.432799 S\n0.629415 0.258831 0.567201 S\n",
"nsites": 12,
"nelements": 4,
"elements": [
"K",
"Th",
"Cu",
"S"
],
"chemical_system": "Cu-K-S-Th",
"density": 4.83811916029676,
"density_atomic": 0.04057187122622847,
"volume": 295.77142087157097,
"volume_molar": 14.843142743948352,
"formula_full": "K2 Th2 Cu2 S6",
"formula_reduced": "KThCuS3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 1.159505675,
"spacegroup": 63
},
{
"id": "jvasp-44719",
"created_at": "2022-09-04T14:38:11.669969Z",
"updated_at": "2022-09-04T14:38:11.669986Z",
"structure_string": "Li4 Mn3 W1 O8\n1.0\n10.253169 -0.133538 -0.081696\n8.497156 5.739656 -0.081696\n13.623740 4.073331 2.492014\nLi Mn W O\n4 3 1 8\ndirect\n0.000001 0.000000 0.499999 Li\n0.000001 0.500001 0.499999 Li\n0.500001 0.000001 0.499999 Li\n0.500002 0.500002 0.499998 Li\n0.000000 0.500001 -0.000001 Mn\n0.500001 0.000000 -0.000001 Mn\n0.500001 0.500001 -0.000001 Mn\n0.000000 0.000000 0.000000 W\n0.000000 0.000000 0.263188 O\n0.000001 0.541364 0.225191 O\n0.541364 0.000001 0.225191 O\n0.000001 0.000001 0.736810 O\n0.458638 0.458638 0.307917 O\n0.000001 0.458638 0.774806 O\n0.458639 0.000001 0.774806 O\n0.541365 0.541365 0.692079 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Mn",
"W",
"O"
],
"chemical_system": "Li-Mn-O-W",
"density": 5.348540424363798,
"density_atomic": 0.10216910956868307,
"volume": 156.60310702075776,
"volume_molar": 5.894287212077172,
"formula_full": "Li4 Mn3 W1 O8",
"formula_reduced": "Li4Mn3WO8",
"formula_anonymous": "AB3C4D8",
"energy_above_hull": 3.2058087327586207,
"spacegroup": 166
},
{
"id": "jvasp-50663",
"created_at": "2022-09-04T14:37:07.720893Z",
"updated_at": "2022-09-04T14:37:07.720911Z",
"structure_string": "Li3 Ti1 P2 O8\n1.0\n4.954826 -0.003537 -0.007425\n1.930836 4.563309 -0.000766\n0.042996 0.019957 6.124318\nLi Ti P O\n3 1 2 8\ndirect\n0.671466 0.166277 0.274147 Li\n0.002087 0.497112 0.501604 Li\n0.332783 0.827881 0.729089 Li\n0.002184 0.497016 0.001617 Ti\n0.651627 0.146481 0.762476 P\n0.352743 0.847558 0.240765 P\n0.247005 0.741857 0.443001 O\n0.247748 0.742562 0.030718 O\n0.307251 0.256592 0.768046 O\n0.761736 0.802112 0.768048 O\n0.242648 0.191925 0.235179 O\n0.697127 0.737428 0.235206 O\n0.756640 0.251455 0.972520 O\n0.757363 0.252192 0.560239 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Ti",
"P",
"O"
],
"chemical_system": "Li-O-P-Ti",
"density": 3.1004982301071413,
"density_atomic": 0.10107109061730346,
"volume": 138.51636421941595,
"volume_molar": 5.958321734948217,
"formula_full": "Li3 Ti1 P2 O8",
"formula_reduced": "Li3Ti(PO4)2",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.5657283809523808,
"spacegroup": 12
},
{
"id": "jvasp-10195",
"created_at": "2022-09-04T14:38:11.656858Z",
"updated_at": "2022-09-04T14:38:11.656886Z",
"structure_string": "Ba3 Sr1 Ta2 O9\n1.0\n3.006069 -5.206665 0.000000\n3.006069 5.206665 -0.000000\n0.000000 -0.000000 7.565966\nBa Sr Ta O\n3 1 2 9\ndirect\n0.333333 0.666667 0.318502 Ba\n0.000000 0.000000 0.000000 Ba\n0.666667 0.333333 0.681499 Ba\n0.000000 0.000000 0.500000 Sr\n0.333333 0.666667 0.836327 Ta\n0.666667 0.333333 0.163673 Ta\n0.500000 0.000000 0.000000 O\n0.000000 0.500000 0.000000 O\n0.500000 0.500000 0.000000 O\n0.821340 0.642680 0.302502 O\n0.821340 0.178661 0.302502 O\n0.357321 0.178661 0.302502 O\n0.178661 0.357321 0.697499 O\n0.178661 0.821340 0.697499 O\n0.642680 0.821340 0.697499 O\n",
"nsites": 15,
"nelements": 4,
"elements": [
"Ba",
"Sr",
"Ta",
"O"
],
"chemical_system": "Ba-O-Sr-Ta",
"density": 7.049762379572075,
"density_atomic": 0.06333420118449402,
"volume": 236.83885988085086,
"volume_molar": 9.508513010936005,
"formula_full": "Ba3 Sr1 Ta2 O9",
"formula_reduced": "Ba3SrTa2O9",
"formula_anonymous": "AB2C3D9",
"energy_above_hull": 2.5857302746666666,
"spacegroup": 164
},
{
"id": "jvasp-28699",
"created_at": "2022-09-04T14:38:11.865237Z",
"updated_at": "2022-09-04T14:38:11.865248Z",
"structure_string": "Te2 Mo3 W1 S6\n1.0\n3.276883 0.000000 0.000000\n-1.638442 2.837849 -0.000057\n0.000000 -0.000569 35.234910\nTe Mo W S\n2 3 1 6\ndirect\n0.333350 0.666701 0.338145 Te\n0.333331 0.666663 0.228349 Te\n0.333303 0.666606 0.090742 Mo\n0.666673 0.333347 0.283247 Mo\n0.666693 0.333386 0.652206 Mo\n0.333331 0.666662 0.476715 W\n0.333363 0.666728 0.695868 S\n0.666631 0.333262 0.047117 S\n0.666653 0.333307 0.432782 S\n0.666647 0.333293 0.134427 S\n0.666673 0.333346 0.520632 S\n0.333348 0.666698 0.608516 S\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Te",
"Mo",
"W",
"S"
],
"chemical_system": "Mo-S-Te-W",
"density": 4.658642142958682,
"density_atomic": 0.03662333260165626,
"volume": 327.6599683191395,
"volume_molar": 16.443453755291657,
"formula_full": "Te2 Mo3 W1 S6",
"formula_reduced": "Te2Mo3WS6",
"formula_anonymous": "AB2C3D6",
"energy_above_hull": 3.917021936111111,
"spacegroup": 156
},
{
"id": "jvasp-9509",
"created_at": "2022-09-04T14:37:17.962236Z",
"updated_at": "2022-09-04T14:37:17.962262Z",
"structure_string": "Mg2 Fe2 Si2 O10\n1.0\n5.015743 -0.288344 0.107276\n-1.486464 5.163625 -0.059771\n-1.448185 -2.234944 6.155539\nMg Fe Si O\n2 2 2 10\ndirect\n0.363851 0.215928 0.779175 Mg\n0.644651 0.773924 0.249921 Mg\n0.004249 0.494920 0.514557 Fe\n0.004253 0.494923 0.014557 Fe\n0.700083 0.817515 0.757848 Si\n0.308417 0.172333 0.271262 Si\n0.703064 0.632164 0.920914 O\n0.990778 0.850864 0.668321 O\n0.305433 0.357681 0.108195 O\n0.017717 0.138981 0.360787 O\n0.597804 0.291359 0.487150 O\n0.304802 0.865653 0.134503 O\n0.410694 0.698486 0.541964 O\n0.703694 0.124192 0.894609 O\n0.898485 0.549451 0.263918 O\n0.110013 0.440393 0.765195 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Mg",
"Fe",
"Si",
"O"
],
"chemical_system": "Fe-Mg-O-Si",
"density": 3.9754172278775357,
"density_atomic": 0.10174872940339567,
"volume": 157.25012089896455,
"volume_molar": 5.918639766128639,
"formula_full": "Mg2 Fe2 Si2 O10",
"formula_reduced": "MgFeSiO5",
"formula_anonymous": "ABCD5",
"energy_above_hull": 2.29657758125,
"spacegroup": 2
},
{
"id": "jvasp-12616",
"created_at": "2022-09-04T14:37:07.664977Z",
"updated_at": "2022-09-04T14:37:07.664994Z",
"structure_string": "Ba2 Nd2 Co4 O11\n1.0\n3.830185 0.000000 0.000000\n0.000000 7.585376 0.000000\n0.000000 0.000000 7.984018\nBa Nd Co O\n2 2 4 11\ndirect\n0.500001 0.000000 0.752719 Ba\n0.500001 0.000000 0.247282 Ba\n0.500001 0.500000 0.268450 Nd\n0.500001 0.500000 0.731550 Nd\n0.000000 0.254162 0.000000 Co\n0.000000 0.745839 0.000000 Co\n0.000000 0.751921 0.500000 Co\n0.000000 0.248079 0.500000 Co\n0.000000 0.000000 0.000000 O\n0.500001 0.695221 0.000000 O\n0.500001 0.304780 0.000000 O\n0.500001 0.732916 0.500000 O\n0.000000 0.711579 0.235271 O\n0.000000 0.711579 0.764730 O\n0.000000 0.288421 0.235271 O\n0.000000 0.500000 0.500000 O\n0.000000 0.288421 0.764730 O\n0.500001 0.267085 0.500000 O\n0.000000 0.000000 0.500000 O\n",
"nsites": 19,
"nelements": 4,
"elements": [
"Ba",
"Nd",
"Co",
"O"
],
"chemical_system": "Ba-Co-Nd-O",
"density": 6.978704974278444,
"density_atomic": 0.08190967998749013,
"volume": 231.9628156635678,
"volume_molar": 7.352172247431253,
"formula_full": "Ba2 Nd2 Co4 O11",
"formula_reduced": "Ba2Nd2Co4O11",
"formula_anonymous": "A2B2C4D11",
"energy_above_hull": 2.7011519494736844,
"spacegroup": 47
}
]
}