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=chemical_system&page=4542",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=4540",
"results": [
{
"id": "jvasp-16487",
"created_at": "2022-09-04T14:38:00.732344Z",
"updated_at": "2022-09-04T14:38:00.732369Z",
"structure_string": "Ta1 Se2\n1.0\n1.753554 -3.037243 -0.000000\n1.753554 3.037243 -0.000000\n-0.000000 0.000000 6.334223\nTa Se\n1 2\ndirect\n0.000000 0.000000 0.000000 Ta\n0.666666 0.333332 0.739291 Se\n0.333332 0.666666 0.260708 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ta",
"Se"
],
"chemical_system": "Se-Ta",
"density": 8.339835307574983,
"density_atomic": 0.044463047505231834,
"volume": 67.47175842247428,
"volume_molar": 13.54414755149519,
"formula_full": "Ta1 Se2",
"formula_reduced": "TaSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.541538644444444,
"spacegroup": 164
},
{
"id": "jvasp-14746",
"created_at": "2022-09-04T14:35:44.179550Z",
"updated_at": "2022-09-04T14:35:44.179577Z",
"structure_string": "Ta2 Se4\n1.0\n1.737113 -3.008768 -0.000000\n1.737113 3.008768 -0.000000\n0.000000 -0.000000 12.870908\nTa Se\n2 4\ndirect\n0.000000 0.000000 0.250000 Ta\n0.000000 0.000000 0.750000 Ta\n0.333332 0.666666 0.380315 Se\n0.666666 0.333332 0.880315 Se\n0.666666 0.333332 0.619686 Se\n0.333332 0.666666 0.119685 Se\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ta",
"Se"
],
"chemical_system": "Se-Ta",
"density": 8.36476116389632,
"density_atomic": 0.044595937363706324,
"volume": 134.54140342575246,
"volume_molar": 13.503787824630459,
"formula_full": "Ta2 Se4",
"formula_reduced": "TaSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.5359619777777773,
"spacegroup": 194
},
{
"id": "jvasp-595",
"created_at": "2022-09-04T14:35:43.177289Z",
"updated_at": "2022-09-04T14:35:43.177313Z",
"structure_string": "Ta1 Se2\n1.0\n3.373372 -0.006840 5.889623\n1.561993 2.989961 5.889623\n-0.011317 -0.006840 6.787281\nTa Se\n1 2\ndirect\n0.000000 0.000000 0.000000 Ta\n0.248209 0.248209 0.248210 Se\n0.751789 0.751790 0.751791 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ta",
"Se"
],
"chemical_system": "Se-Ta",
"density": 8.178417674038146,
"density_atomic": 0.043602464574821725,
"volume": 68.80345020066486,
"volume_molar": 13.811468729401799,
"formula_full": "Ta1 Se2",
"formula_reduced": "TaSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.5438919777777773,
"spacegroup": 166
},
{
"id": "jvasp-93228",
"created_at": "2022-09-04T14:35:46.609736Z",
"updated_at": "2022-09-04T14:35:46.609765Z",
"structure_string": "Ta2 Se4\n1.0\n-1.737284 -3.008881 -0.000000\n-1.737284 3.008881 0.000000\n0.000000 0.000000 -12.873206\nTa Se\n2 4\ndirect\n-0.000010 0.000010 0.750000 Ta\n0.000010 -0.000010 0.250000 Ta\n0.666642 0.333355 0.619710 Se\n0.333355 0.666642 0.380290 Se\n0.333355 0.666642 0.119710 Se\n0.666642 0.333355 0.880290 Se\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ta",
"Se"
],
"chemical_system": "Se-Ta",
"density": 8.362130719767325,
"density_atomic": 0.0445819133982497,
"volume": 134.5837256109237,
"volume_molar": 13.508035660569991,
"formula_full": "Ta2 Se4",
"formula_reduced": "TaSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.536068644444444,
"spacegroup": 194
},
{
"id": "jvasp-16099",
"created_at": "2022-09-04T14:36:07.182050Z",
"updated_at": "2022-09-04T14:36:07.182076Z",
"structure_string": "Ta4 Se2\n1.0\n3.391666 0.000000 0.000000\n0.000000 3.391666 0.000000\n0.000000 0.000000 10.131989\nTa Se\n4 2\ndirect\n0.000000 0.500001 0.763929 Ta\n0.500001 0.000000 0.236071 Ta\n0.500001 0.000000 0.924920 Ta\n0.000000 0.500001 0.075080 Ta\n0.500001 0.000000 0.641194 Se\n0.000000 0.500001 0.358807 Se\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ta",
"Se"
],
"chemical_system": "Se-Ta",
"density": 12.561883092812803,
"density_atomic": 0.05147903356534959,
"volume": 116.55230458791257,
"volume_molar": 11.69823973551339,
"formula_full": "Ta4 Se2",
"formula_reduced": "Ta2Se",
"formula_anonymous": "AB2",
"energy_above_hull": 4.236767255555555,
"spacegroup": 129
},
{
"id": "jvasp-596",
"created_at": "2022-09-04T14:36:03.151631Z",
"updated_at": "2022-09-04T14:36:03.151660Z",
"structure_string": "Ta1 Se2\n1.0\n3.447526 -0.000000 0.492995\n1.723763 2.999418 0.246502\n0.821964 0.000012 6.772853\nTa Se\n1 2\ndirect\n0.081937 0.836125 -0.000000 Ta\n0.877392 0.503940 0.745300 Se\n0.618669 0.503936 0.254700 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ta",
"Se"
],
"chemical_system": "Se-Ta",
"density": 8.176482489359147,
"density_atomic": 0.043592147319727305,
"volume": 68.81973438923418,
"volume_molar": 13.814737585259362,
"formula_full": "Ta1 Se2",
"formula_reduced": "TaSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.538521977777777,
"spacegroup": 42
},
{
"id": "jvasp-78267",
"created_at": "2022-09-04T14:37:14.866989Z",
"updated_at": "2022-09-04T14:37:14.867014Z",
"structure_string": "Ta1 Se2\n1.0\n-1.736660 -3.007984 -0.000000\n1.736660 -3.007984 -0.000000\n-0.000000 -2.005322 6.493688\nTa Se\n1 2\ndirect\n-0.000029 -0.000029 0.000087 Ta\n0.752647 0.752647 0.742057 Se\n0.580381 0.580381 0.258856 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ta",
"Se"
],
"chemical_system": "Se-Ta",
"density": 8.294071325920562,
"density_atomic": 0.044219061141558574,
"volume": 67.84404558921081,
"volume_molar": 13.618879742202822,
"formula_full": "Ta1 Se2",
"formula_reduced": "TaSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.53663531111111,
"spacegroup": 160
},
{
"id": "jvasp-28386",
"created_at": "2022-09-04T14:36:55.411810Z",
"updated_at": "2022-09-04T14:36:55.411835Z",
"structure_string": "Ta2 Se4\n1.0\n3.472666 0.000000 0.000000\n-1.736333 3.007070 0.000000\n-0.000000 0.000000 13.091310\nTa Se\n2 4\ndirect\n0.333361 0.666720 0.250000 Ta\n0.666641 0.333280 0.750000 Ta\n0.333288 0.666574 0.878204 Se\n0.666714 0.333426 0.121796 Se\n0.666714 0.333426 0.378204 Se\n0.333288 0.666574 0.621796 Se\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ta",
"Se"
],
"chemical_system": "Se-Ta",
"density": 8.23227441629978,
"density_atomic": 0.043889596730474864,
"volume": 136.70665594960647,
"volume_molar": 13.721112082623694,
"formula_full": "Ta2 Se4",
"formula_reduced": "TaSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.5373353111111108,
"spacegroup": 194
},
{
"id": "jvasp-29350",
"created_at": "2022-09-04T14:38:39.325698Z",
"updated_at": "2022-09-04T14:38:39.325716Z",
"structure_string": "Ta13 Se26\n1.0\n8.600047 0.035571 1.957326\n-0.147919 9.167996 2.511693\n0.028436 0.035341 11.268757\nTa Se\n13 26\ndirect\n0.000000 0.000000 0.000000 Ta\n0.640479 0.849258 0.513302 Ta\n0.512104 0.638489 0.848179 Ta\n0.487897 0.361511 0.151821 Ta\n0.849221 0.513159 0.638571 Ta\n0.150780 0.486841 0.361429 Ta\n0.359522 0.150743 0.486698 Ta\n0.930714 0.786664 0.283119 Ta\n0.282051 0.930042 0.786417 Ta\n0.717950 0.069958 0.213583 Ta\n0.786311 0.282721 0.930377 Ta\n0.213690 0.717280 0.069624 Ta\n0.069287 0.213336 0.716881 Ta\n0.483193 0.342644 0.934407 Se\n0.516808 0.657356 0.065593 Se\n0.323820 0.878184 0.556497 Se\n0.676181 0.121816 0.443503 Se\n0.177483 0.421848 0.159181 Se\n0.596529 0.896196 0.749034 Se\n0.403472 0.103804 0.250966 Se\n0.082661 0.194244 0.476773 Se\n0.917340 0.805756 0.523227 Se\n0.140516 0.498395 0.602457 Se\n0.822518 0.578152 0.840819 Se\n0.859484 0.501606 0.397543 Se\n0.624288 0.794502 0.309465 Se\n0.223747 0.644622 0.856451 Se\n0.227432 0.753280 0.292777 Se\n0.772569 0.246720 0.707223 Se\n0.375712 0.205498 0.690535 Se\n0.554390 0.573537 0.628400 Se\n0.006901 0.058043 0.217829 Se\n-0.006900 0.941957 0.782171 Se\n0.304262 0.984284 0.993019 Se\n0.695739 0.015717 0.006981 Se\n0.079706 0.281917 0.919175 Se\n0.920295 0.718083 0.080825 Se\n0.776253 0.355379 0.143549 Se\n0.445610 0.426463 0.371600 Se\n",
"nsites": 39,
"nelements": 2,
"elements": [
"Ta",
"Se"
],
"chemical_system": "Se-Ta",
"density": 8.244595661491381,
"density_atomic": 0.043955286290289095,
"volume": 887.2652936995237,
"volume_molar": 13.70060638492634,
"formula_full": "Ta13 Se26",
"formula_reduced": "TaSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.535368644444444,
"spacegroup": 2
},
{
"id": "jvasp-589",
"created_at": "2022-09-04T14:35:56.379367Z",
"updated_at": "2022-09-04T14:35:56.379394Z",
"structure_string": "Ta1 Se2\n1.0\n1.753552 -3.037240 0.000000\n1.753552 3.037240 0.000000\n-0.000000 -0.000000 6.334270\nTa Se\n1 2\ndirect\n0.000000 0.000000 0.000000 Ta\n0.666666 0.333332 0.739293 Se\n0.333332 0.666666 0.260707 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ta",
"Se"
],
"chemical_system": "Se-Ta",
"density": 8.339791175761157,
"density_atomic": 0.04446281222061742,
"volume": 67.47211546391794,
"volume_molar": 13.544219223289552,
"formula_full": "Ta1 Se2",
"formula_reduced": "TaSe2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.541538644444444,
"spacegroup": 164
},
{
"id": "jvasp-98047",
"created_at": "2022-09-04T14:35:58.835550Z",
"updated_at": "2022-09-04T14:35:58.835574Z",
"structure_string": "Ta4 Tl8 Se22\n1.0\n8.011729 -0.031811 0.109800\n0.613380 8.803523 2.723774\n-0.003763 -0.013085 13.968177\nTa Tl Se\n4 8 22\ndirect\n0.121446 0.367634 0.302074 Ta\n0.878555 0.632366 0.697926 Ta\n0.662408 0.893411 0.811538 Ta\n0.337592 0.106590 0.188462 Ta\n0.756430 0.586789 0.420016 Tl\n0.243570 0.413211 0.579984 Tl\n0.056748 0.760673 0.986292 Tl\n0.504882 0.283386 0.887466 Tl\n0.785215 0.020669 0.426929 Tl\n0.214785 0.979331 0.573071 Tl\n0.943252 0.239327 0.013708 Tl\n0.495118 0.716614 0.112534 Tl\n0.655994 0.147449 0.665909 Se\n0.608037 0.822184 0.628918 Se\n0.391963 0.177816 0.371082 Se\n0.945355 0.338515 0.751857 Se\n0.054645 0.661486 0.248143 Se\n0.875907 0.506546 0.183802 Se\n0.124093 0.493454 0.816198 Se\n0.596532 0.552640 0.649708 Se\n0.403469 0.447360 0.350292 Se\n0.344007 0.852551 0.334091 Se\n0.261876 0.402618 0.109342 Se\n0.395958 0.080007 0.753487 Se\n0.975044 0.870607 0.751835 Se\n0.024956 0.129393 0.248165 Se\n0.738124 0.597383 0.890658 Se\n0.021867 0.710545 0.534834 Se\n0.552928 0.307940 0.119526 Se\n0.447073 0.692060 0.880474 Se\n0.728042 0.965245 0.961088 Se\n0.271958 0.034755 0.038912 Se\n0.604042 0.919993 0.246513 Se\n0.978133 0.289456 0.465166 Se\n",
"nsites": 34,
"nelements": 3,
"elements": [
"Ta",
"Tl",
"Se"
],
"chemical_system": "Se-Ta-Tl",
"density": 6.899806535380941,
"density_atomic": 0.034491265284079066,
"volume": 985.756820457792,
"volume_molar": 17.459900964490796,
"formula_full": "Ta4 Tl8 Se22",
"formula_reduced": "Ta2Tl4Se11",
"formula_anonymous": "A2B4C11",
"energy_above_hull": 1.8985991666666668,
"spacegroup": 2
},
{
"id": "jvasp-3120",
"created_at": "2022-09-04T14:36:05.639850Z",
"updated_at": "2022-09-04T14:36:05.639873Z",
"structure_string": "Ta1 Tl3 Se4\n1.0\n6.488948 -0.000000 -2.294189\n-3.244473 5.619593 -2.294189\n0.000000 0.000000 6.882568\nTa Tl Se\n1 3 4\ndirect\n0.000000 0.000000 0.000000 Ta\n0.000000 0.500000 0.500000 Tl\n0.500000 0.000000 0.500000 Tl\n0.500000 0.500000 -0.000000 Tl\n0.000000 0.000000 0.648736 Se\n0.000000 0.648736 -0.000000 Se\n0.648736 0.000000 0.000000 Se\n0.351264 0.351264 0.351264 Se\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ta",
"Tl",
"Se"
],
"chemical_system": "Se-Ta-Tl",
"density": 7.343753043164211,
"density_atomic": 0.031875743195548485,
"volume": 250.9745404498433,
"volume_molar": 18.892550122065877,
"formula_full": "Ta1 Tl3 Se4",
"formula_reduced": "TaTl3Se4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 1.431035058333333,
"spacegroup": 217
}
]
}