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=-energy_above_hull&page=2",
"previous": null,
"results": [
{
"id": "jvasp-121134",
"created_at": "2022-09-04T14:38:52.608551Z",
"updated_at": "2022-09-04T14:38:52.608571Z",
"structure_string": "I1 F1\n1.0\n4.307260 0.000000 0.000000\n0.000000 4.307260 0.000000\n0.000000 0.000000 4.303869\nI F\n1 1\ndirect\n0.000000 0.000000 0.749954 I\n0.000000 0.000000 0.250046 F\n",
"nsites": 2,
"nelements": 2,
"elements": [
"I",
"F"
],
"chemical_system": "F-I",
"density": 3.034252524667383,
"density_atomic": 0.025047753221691876,
"volume": 79.84748102148971,
"volume_molar": 24.042638502141987,
"formula_full": "I1 F1",
"formula_reduced": "IF",
"formula_anonymous": "AB",
"energy_above_hull": null,
"spacegroup": 123
},
{
"id": "jvasp-123673",
"created_at": "2022-09-04T14:38:52.665037Z",
"updated_at": "2022-09-04T14:38:52.665074Z",
"structure_string": "Ir1 Se2\n1.0\n1.862071 -3.221516 -0.013289\n1.858880 3.219674 0.000000\n0.023154 -0.013368 5.162128\nIr Se\n1 2\ndirect\n0.000000 0.333338 0.166667 Ir\n0.665505 0.666082 0.422060 Se\n0.334494 0.000576 0.911273 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ir",
"Se"
],
"chemical_system": "Ir-Se",
"density": 9.398512052587844,
"density_atomic": 0.04849458572056079,
"volume": 61.86257610873984,
"volume_molar": 12.418171370101478,
"formula_full": "Ir1 Se2",
"formula_reduced": "IrSe2",
"formula_anonymous": "AB2",
"energy_above_hull": null,
"spacegroup": 164
},
{
"id": "jvasp-123692",
"created_at": "2022-09-04T14:38:52.871000Z",
"updated_at": "2022-09-04T14:38:52.871016Z",
"structure_string": "Pb1 Se2\n1.0\n2.397684 -3.996667 -0.897470\n2.262376 3.918547 -0.000001\n-1.161625 0.670664 5.756253\nPb Se\n1 2\ndirect\n0.000000 0.333365 0.166667 Pb\n0.811598 0.739117 0.444196 Se\n0.188403 -0.072481 0.889137 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Pb",
"Se"
],
"chemical_system": "Pb-Se",
"density": 6.021804947402711,
"density_atomic": 0.029796360403474727,
"volume": 100.68343782182714,
"volume_molar": 20.210994492125028,
"formula_full": "Pb1 Se2",
"formula_reduced": "PbSe2",
"formula_anonymous": "AB2",
"energy_above_hull": null,
"spacegroup": 12
},
{
"id": "jvasp-121206",
"created_at": "2022-09-04T14:38:55.039022Z",
"updated_at": "2022-09-04T14:38:55.039050Z",
"structure_string": "Li1 Te2\n1.0\n5.594443 0.000000 0.000000\n-2.797221 4.844930 -0.000000\n-0.000000 0.000000 3.248611\nLi Te\n1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.333333 0.666667 0.000000 Te\n0.666666 0.333334 0.000000 Te\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"Te"
],
"chemical_system": "Li-Te",
"density": 4.943584691736032,
"density_atomic": 0.03407055311786841,
"volume": 88.05257694588586,
"volume_molar": 17.675500421628517,
"formula_full": "Li1 Te2",
"formula_reduced": "LiTe2",
"formula_anonymous": "AB2",
"energy_above_hull": null,
"spacegroup": 191
},
{
"id": "jvasp-123725",
"created_at": "2022-09-04T14:38:55.002191Z",
"updated_at": "2022-09-04T14:38:55.002217Z",
"structure_string": "Yb1 Se2\n1.0\n2.413715 -3.881227 -0.958059\n2.154386 3.731503 -0.000001\n-1.136627 0.656231 5.444317\nYb Se\n1 2\ndirect\n0.000000 0.333320 0.166667 Yb\n0.793036 0.729856 0.428805 Se\n0.206964 -0.063179 0.904529 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Yb",
"Se"
],
"chemical_system": "Se-Yb",
"density": 6.165171326476543,
"density_atomic": 0.033654395894115424,
"volume": 89.14140100564275,
"volume_molar": 17.89406881331954,
"formula_full": "Yb1 Se2",
"formula_reduced": "YbSe2",
"formula_anonymous": "AB2",
"energy_above_hull": null,
"spacegroup": 12
},
{
"id": "jvasp-123688",
"created_at": "2022-09-04T14:38:52.745697Z",
"updated_at": "2022-09-04T14:38:52.745721Z",
"structure_string": "Se2 O1\n1.0\n1.838572 -3.402694 0.029554\n2.027535 3.511792 0.000000\n0.034759 -0.020068 4.408377\nSe O\n2 1\ndirect\n0.746207 0.783059 0.473363 Se\n0.253792 0.036852 0.859971 Se\n-0.000000 0.180087 0.166667 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Se",
"O"
],
"chemical_system": "O-Se",
"density": 4.905521187703391,
"density_atomic": 0.05095763745227018,
"volume": 58.87243110142166,
"volume_molar": 11.817935565872103,
"formula_full": "Se2 O1",
"formula_reduced": "Se2O",
"formula_anonymous": "AB2",
"energy_above_hull": null,
"spacegroup": 5
},
{
"id": "jvasp-122917",
"created_at": "2022-09-04T14:38:55.031858Z",
"updated_at": "2022-09-04T14:38:55.031872Z",
"structure_string": "Ar1 V1\n1.0\n3.947827 0.000000 -0.000000\n0.000000 3.947827 0.000000\n0.000000 0.000000 3.947827\nAr V\n1 1\ndirect\n0.000000 0.000000 0.000000 Ar\n0.500000 0.500000 0.500000 V\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ar",
"V"
],
"chemical_system": "Ar-V",
"density": 2.452948741138939,
"density_atomic": 0.032505410638871114,
"volume": 61.528218247097904,
"volume_molar": 18.526579549801202,
"formula_full": "Ar1 V1",
"formula_reduced": "ArV",
"formula_anonymous": "AB",
"energy_above_hull": null,
"spacegroup": 221
},
{
"id": "jvasp-121274",
"created_at": "2022-09-04T14:38:54.990799Z",
"updated_at": "2022-09-04T14:38:54.990825Z",
"structure_string": "As1 Br1\n1.0\n7.408481 0.000000 0.000000\n0.000000 7.408481 0.000000\n0.000000 0.000000 10.583545\nAs Br\n1 1\ndirect\n0.000000 0.000000 0.883711 As\n0.000000 0.000000 0.116289 Br\n",
"nsites": 2,
"nelements": 2,
"elements": [
"As",
"Br"
],
"chemical_system": "As-Br",
"density": 0.4425907831894822,
"density_atomic": 0.0034430275049691906,
"volume": 580.8841193146079,
"volume_molar": 174.90829658806018,
"formula_full": "As1 Br1",
"formula_reduced": "AsBr",
"formula_anonymous": "AB",
"energy_above_hull": null,
"spacegroup": 99
},
{
"id": "jvasp-122939",
"created_at": "2022-09-04T14:38:53.441742Z",
"updated_at": "2022-09-04T14:38:53.441771Z",
"structure_string": "Dy1 V1\n1.0\n3.455115 0.000000 0.000000\n0.000000 3.455115 0.000000\n-0.000000 -0.000000 3.455115\nDy V\n1 1\ndirect\n0.000000 0.000000 0.000000 Dy\n0.500001 0.500001 0.500001 V\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Dy",
"V"
],
"chemical_system": "Dy-V",
"density": 8.592913515294468,
"density_atomic": 0.04848891592824507,
"volume": 41.24653978570365,
"volume_molar": 12.419623422622383,
"formula_full": "Dy1 V1",
"formula_reduced": "DyV",
"formula_anonymous": "AB",
"energy_above_hull": null,
"spacegroup": 221
},
{
"id": "jvasp-105719",
"created_at": "2022-09-04T14:35:59.976858Z",
"updated_at": "2022-09-04T14:35:59.976885Z",
"structure_string": "Ba2 Tl1 Hg1\n1.0\n5.153573 0.000000 2.975417\n1.717857 4.858836 2.975417\n0.000000 0.000000 5.950834\nBa Tl Hg\n2 1 1\ndirect\n0.750000 0.750001 0.750000 Ba\n0.250000 0.250000 0.250000 Ba\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"Hg"
],
"chemical_system": "Ba-Hg-Tl",
"density": 7.57358327019736,
"density_atomic": 0.02684364476028033,
"volume": 149.01106149037815,
"volume_molar": 22.43413967730182,
"formula_full": "Ba2 Tl1 Hg1",
"formula_reduced": "Ba2TlHg",
"formula_anonymous": "ABC2",
"energy_above_hull": null,
"spacegroup": 225
},
{
"id": "jvasp-122915",
"created_at": "2022-09-04T14:38:54.987800Z",
"updated_at": "2022-09-04T14:38:54.987827Z",
"structure_string": "V1 Ag1\n1.0\n3.162408 0.000000 0.000000\n0.000000 3.162408 0.000000\n0.000000 -0.000000 3.162408\nV Ag\n1 1\ndirect\n0.500000 0.500000 0.500000 V\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 2,
"nelements": 2,
"elements": [
"V",
"Ag"
],
"chemical_system": "Ag-V",
"density": 8.338202207423315,
"density_atomic": 0.06323773345809323,
"volume": 31.626686957801425,
"volume_molar": 9.523018031616818,
"formula_full": "V1 Ag1",
"formula_reduced": "VAg",
"formula_anonymous": "AB",
"energy_above_hull": null,
"spacegroup": 221
},
{
"id": "jvasp-122067",
"created_at": "2022-09-04T14:38:52.674889Z",
"updated_at": "2022-09-04T14:38:52.674917Z",
"structure_string": "Tl8 Cu2 Te2 O12\n1.0\n5.750879 0.055614 1.706718\n0.552734 8.103026 3.394754\n-0.004599 0.031457 9.249604\nTl Cu Te O\n8 2 2 12\ndirect\n0.919960 0.110293 0.797741 Tl\n0.080039 0.889707 0.202259 Tl\n0.873882 0.254073 0.345412 Tl\n0.126118 0.745928 0.654588 Tl\n0.273080 0.390073 0.465863 Tl\n0.726919 0.609927 0.534136 Tl\n0.509285 0.923939 0.763050 Tl\n0.490714 0.076062 0.236950 Tl\n0.776065 0.444511 0.944281 Cu\n0.223935 0.555489 0.055718 Cu\n0.658711 0.668342 0.135487 Te\n0.341288 0.331658 0.864512 Te\n0.631126 0.256300 0.953457 O\n0.270321 0.108234 0.920510 O\n0.729678 0.891766 0.079489 O\n0.536944 0.347283 0.652413 O\n0.463055 0.652717 0.347586 O\n0.837126 0.665973 0.920070 O\n0.162873 0.334028 0.079929 O\n0.937794 0.574612 0.228585 O\n0.062205 0.425388 0.771414 O\n0.402553 0.560158 0.833286 O\n0.597446 0.439842 0.166714 O\n0.368874 0.743700 0.046543 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Tl",
"Cu",
"Te",
"O"
],
"chemical_system": "Cu-O-Te-Tl",
"density": 8.527508743536163,
"density_atomic": 0.0557852727118647,
"volume": 430.2210750848504,
"volume_molar": 10.795216133664576,
"formula_full": "Tl8 Cu2 Te2 O12",
"formula_reduced": "Tl4CuTeO6",
"formula_anonymous": "ABC4D6",
"energy_above_hull": null,
"spacegroup": 2
}
]
}