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=524",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=522",
"results": [
{
"id": "jvasp-114025",
"created_at": "2022-09-04T14:38:46.979533Z",
"updated_at": "2022-09-04T14:38:46.979559Z",
"structure_string": "S2 F2\n1.0\n3.167324 0.000000 -0.000000\n-0.000000 3.167324 0.000000\n-0.000000 -0.000000 6.775686\nS F\n2 2\ndirect\n0.000000 0.000000 0.249902 S\n0.499998 0.499998 0.750098 S\n0.000000 0.000000 0.749931 F\n0.499998 0.499998 0.250070 F\n",
"nsites": 4,
"nelements": 2,
"elements": [
"S",
"F"
],
"chemical_system": "F-S",
"density": 2.494885356322443,
"density_atomic": 0.05884664890893395,
"volume": 67.9732843613586,
"volume_molar": 10.233617158590205,
"formula_full": "S2 F2",
"formula_reduced": "SF",
"formula_anonymous": "AB",
"energy_above_hull": 0.7723424999999999,
"spacegroup": 139
},
{
"id": "jvasp-120370",
"created_at": "2022-09-04T14:38:48.521600Z",
"updated_at": "2022-09-04T14:38:48.521636Z",
"structure_string": "As1 C1\n1.0\n2.484656 -0.000000 -0.000000\n0.000000 2.484656 -0.000000\n0.000000 0.000000 4.482134\nAs C\n1 1\ndirect\n0.000000 0.000000 0.750001 As\n0.000000 0.000000 0.249998 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"As",
"C"
],
"chemical_system": "As-C",
"density": 5.216904572937248,
"density_atomic": 0.07227908080327525,
"volume": 27.670523445690698,
"volume_molar": 8.33178935464148,
"formula_full": "As1 C1",
"formula_reduced": "AsC",
"formula_anonymous": "AB",
"energy_above_hull": 3.923280875,
"spacegroup": 123
},
{
"id": "jvasp-113735",
"created_at": "2022-09-04T14:38:47.008598Z",
"updated_at": "2022-09-04T14:38:47.008630Z",
"structure_string": "Si2 Os2\n1.0\n5.993043 -0.781400 0.336260\n-1.624256 -2.306740 -0.052300\n0.116734 3.499123 -5.583038\nSi Os\n2 2\ndirect\n0.748675 0.436066 0.154973 Si\n0.698452 0.367120 0.637375 Si\n0.017262 0.081939 0.032865 Os\n0.424970 0.270385 0.313786 Os\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Si",
"Os"
],
"chemical_system": "Os-Si",
"density": 8.678054492052325,
"density_atomic": 0.04787609280344227,
"volume": 83.5490067333231,
"volume_molar": 12.578596972656486,
"formula_full": "Si2 Os2",
"formula_reduced": "SiOs",
"formula_anonymous": "AB",
"energy_above_hull": 3.1733818000000005,
"spacegroup": 6
},
{
"id": "jvasp-107087",
"created_at": "2022-09-04T14:38:47.027027Z",
"updated_at": "2022-09-04T14:38:47.027057Z",
"structure_string": "V4 O4\n1.0\n3.226250 -0.138755 0.000014\n-0.603179 8.226356 0.000047\n-0.000012 -0.000017 2.759523\nV O\n4 4\ndirect\n0.926005 0.479908 -0.000001 V\n0.573996 0.770093 0.499999 V\n0.925999 0.979910 -0.000001 V\n0.574003 0.270093 0.500000 V\n0.037494 0.741315 0.000000 O\n0.462500 0.008685 0.499998 O\n0.037498 0.241315 0.000001 O\n0.462506 0.508685 0.500000 O\n",
"nsites": 8,
"nelements": 2,
"elements": [
"V",
"O"
],
"chemical_system": "O-V",
"density": 6.090217469954832,
"density_atomic": 0.10957769278797737,
"volume": 73.00756017448967,
"volume_molar": 5.495772548936837,
"formula_full": "V4 O4",
"formula_reduced": "VO",
"formula_anonymous": "AB",
"energy_above_hull": 1.2937838500000003,
"spacegroup": 11
},
{
"id": "jvasp-118810",
"created_at": "2022-09-04T14:38:47.047363Z",
"updated_at": "2022-09-04T14:38:47.047393Z",
"structure_string": "Na1 Zn1\n1.0\n5.092018 -0.000000 -0.000000\n-2.546009 4.409817 -0.000000\n0.000000 -0.000000 2.754874\nNa Zn\n1 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.333334 0.666668 0.000000 Zn\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Na",
"Zn"
],
"chemical_system": "Na-Zn",
"density": 2.3729198991051805,
"density_atomic": 0.032330897287249506,
"volume": 61.860330761334914,
"volume_molar": 18.626580965245843,
"formula_full": "Na1 Zn1",
"formula_reduced": "NaZn",
"formula_anonymous": "AB",
"energy_above_hull": 0.6560010526315789,
"spacegroup": 187
},
{
"id": "jvasp-113454",
"created_at": "2022-09-04T14:38:47.096009Z",
"updated_at": "2022-09-04T14:38:47.096035Z",
"structure_string": "B1 O1\n1.0\n2.557235 0.008432 0.296599\n-1.287380 -2.230937 -0.017924\n-0.994312 -2.380199 -2.541724\nB O\n1 1\ndirect\n0.893412 0.154552 0.782317 B\n0.226715 0.821052 0.782340 O\n",
"nsites": 2,
"nelements": 2,
"elements": [
"B",
"O"
],
"chemical_system": "B-O",
"density": 3.046168579791689,
"density_atomic": 0.13684582081978858,
"volume": 14.614987787122764,
"volume_molar": 4.40067568298671,
"formula_full": "B1 O1",
"formula_reduced": "BO",
"formula_anonymous": "AB",
"energy_above_hull": 1.9033330416666665,
"spacegroup": 187
},
{
"id": "jvasp-117680",
"created_at": "2022-09-04T14:38:47.140663Z",
"updated_at": "2022-09-04T14:38:47.140700Z",
"structure_string": "Be2 Cl2\n1.0\n2.927777 -0.000000 0.000000\n0.000000 2.927777 -0.000000\n-0.000000 0.000000 7.523695\nBe Cl\n2 2\ndirect\n0.000000 0.000000 0.865985 Be\n0.500001 0.500001 0.134013 Be\n0.000000 0.000000 0.299492 Cl\n0.500001 0.500001 0.700510 Cl\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Be",
"Cl"
],
"chemical_system": "Be-Cl",
"density": 2.289770713436315,
"density_atomic": 0.062023007346307085,
"volume": 64.49219686600966,
"volume_molar": 9.709527186218526,
"formula_full": "Be2 Cl2",
"formula_reduced": "BeCl",
"formula_anonymous": "AB",
"energy_above_hull": 0.6346100837499999,
"spacegroup": 129
},
{
"id": "jvasp-113488",
"created_at": "2022-09-04T14:38:47.211303Z",
"updated_at": "2022-09-04T14:38:47.211321Z",
"structure_string": "Rb1 Cl1\n1.0\n7.668979 0.000000 0.000000\n0.000000 7.668979 0.000000\n0.000000 -0.000000 6.041758\nRb Cl\n1 1\ndirect\n0.000000 0.000000 0.750016 Rb\n0.000000 0.000000 0.249984 Cl\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Rb",
"Cl"
],
"chemical_system": "Cl-Rb",
"density": 0.5650822768117604,
"density_atomic": 0.005628485774354306,
"volume": 355.33535664473413,
"volume_molar": 106.99397673596953,
"formula_full": "Rb1 Cl1",
"formula_reduced": "RbCl",
"formula_anonymous": "AB",
"energy_above_hull": 0.314635,
"spacegroup": 123
},
{
"id": "jvasp-117700",
"created_at": "2022-09-04T14:38:47.226032Z",
"updated_at": "2022-09-04T14:38:47.226051Z",
"structure_string": "Be2 S2\n1.0\n4.845447 0.469096 -0.140337\n-2.191600 -2.654184 -0.057860\n0.299492 -4.595465 -5.116728\nBe S\n2 2\ndirect\n0.960494 0.250584 0.038935 Be\n0.960440 0.250533 0.538938 Be\n0.210530 0.250594 0.288896 S\n0.210508 0.250580 0.788898 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Be",
"S"
],
"chemical_system": "Be-S",
"density": 2.3633678631495325,
"density_atomic": 0.06929654495026151,
"volume": 57.72293557883805,
"volume_molar": 8.690391078404371,
"formula_full": "Be2 S2",
"formula_reduced": "BeS",
"formula_anonymous": "AB",
"energy_above_hull": 0.6031880500000002,
"spacegroup": 216
},
{
"id": "jvasp-117788",
"created_at": "2022-09-04T14:38:47.333658Z",
"updated_at": "2022-09-04T14:38:47.333674Z",
"structure_string": "I1 Br1\n1.0\n5.579311 1.017085 -0.658518\n-3.966680 -4.089688 0.442259\n-0.195577 2.128315 -3.692257\nI Br\n1 1\ndirect\n0.064008 0.578831 0.502940 I\n0.059276 0.076422 -0.003790 Br\n",
"nsites": 2,
"nelements": 2,
"elements": [
"I",
"Br"
],
"chemical_system": "Br-I",
"density": 4.898984409768416,
"density_atomic": 0.02853110775092172,
"volume": 70.09892561691329,
"volume_molar": 21.107279859491086,
"formula_full": "I1 Br1",
"formula_reduced": "IBr",
"formula_anonymous": "AB",
"energy_above_hull": 0.056896,
"spacegroup": 12
},
{
"id": "jvasp-115603",
"created_at": "2022-09-04T14:38:47.339364Z",
"updated_at": "2022-09-04T14:38:47.339387Z",
"structure_string": "Ba2 O2\n1.0\n3.946356 -0.000000 -0.000000\n0.000000 3.946356 0.000000\n0.000000 0.000000 5.585789\nBa O\n2 2\ndirect\n0.000000 0.000000 0.249998 Ba\n0.500001 0.500001 0.750002 Ba\n0.000000 0.000000 0.750047 O\n0.500001 0.500001 0.249953 O\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ba",
"O"
],
"chemical_system": "Ba-O",
"density": 5.853545317032706,
"density_atomic": 0.04598147984481698,
"volume": 86.9915455853011,
"volume_molar": 13.096883311115995,
"formula_full": "Ba2 O2",
"formula_reduced": "BaO",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-19760",
"created_at": "2022-09-04T14:38:16.231138Z",
"updated_at": "2022-09-04T14:38:16.231156Z",
"structure_string": "Ca2 Si2\n1.0\n3.908106 0.000000 -0.000000\n0.000000 4.185835 -1.745501\n-0.000000 -0.032394 5.814029\nCa Si\n2 2\ndirect\n0.250000 0.861161 0.722318 Ca\n0.750001 0.138841 0.277683 Ca\n0.250000 0.570555 0.141108 Si\n0.750001 0.429447 0.858893 Si\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ca",
"Si"
],
"chemical_system": "Ca-Si",
"density": 2.38569850810394,
"density_atomic": 0.042154561405118154,
"volume": 94.88890090822636,
"volume_molar": 14.285857945775776,
"formula_full": "Ca2 Si2",
"formula_reduced": "CaSi",
"formula_anonymous": "AB",
"energy_above_hull": 0.5951745099999997,
"spacegroup": 63
}
]
}