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=4483",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=4481",
"results": [
{
"id": "jvasp-99663",
"created_at": "2022-09-04T14:36:22.326165Z",
"updated_at": "2022-09-04T14:36:22.326195Z",
"structure_string": "Ca2 Ir1 Pt1 O6\n1.0\n5.180271 -0.005584 0.012277\n4.197246 3.036177 0.012277\n-0.009388 -0.003034 7.372185\nCa Ir Pt O\n2 1 1 6\ndirect\n0.750914 0.750917 0.253258 Ca\n0.249084 0.249087 0.746742 Ca\n-0.000001 0.000001 0.500000 Ir\n0.000000 0.000000 0.000000 Pt\n0.370321 0.370322 0.045939 O\n0.629677 0.629681 0.954061 O\n0.375526 0.375528 0.447586 O\n0.624472 0.624475 0.552414 O\n0.082861 0.082862 0.252284 O\n0.917136 0.917141 0.747716 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ca",
"Ir",
"Pt",
"O"
],
"chemical_system": "Ca-Ir-O-Pt",
"density": 8.057182107091819,
"density_atomic": 0.08611445914538506,
"volume": 116.12451729061237,
"volume_molar": 6.993181888111216,
"formula_full": "Ca2 Ir1 Pt1 O6",
"formula_reduced": "Ca2IrPtO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.310271434,
"spacegroup": 12
},
{
"id": "jvasp-92261",
"created_at": "2022-09-04T14:36:08.624988Z",
"updated_at": "2022-09-04T14:36:08.625018Z",
"structure_string": "Fe1 Cu2 Ge1 S4\n1.0\n5.327152 0.000000 -0.000000\n0.000000 5.327152 -0.000000\n-2.663576 -2.663576 5.290423\nFe Cu Ge S\n1 2 1 4\ndirect\n0.000000 0.000000 0.000000 Fe\n0.749999 0.249999 0.500000 Cu\n0.249999 0.749999 0.500000 Cu\n0.500000 0.500000 0.000000 Ge\n0.877887 0.877887 0.251017 S\n0.373129 0.373129 0.251017 S\n0.122112 0.626869 0.748982 S\n0.626869 0.122112 0.748982 S\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Fe",
"Cu",
"Ge",
"S"
],
"chemical_system": "Cu-Fe-Ge-S",
"density": 4.2453681611229594,
"density_atomic": 0.053285544964430116,
"volume": 150.1345253265265,
"volume_molar": 11.301640555651595,
"formula_full": "Fe1 Cu2 Ge1 S4",
"formula_reduced": "FeCu2GeS4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.5489002937499998,
"spacegroup": 121
},
{
"id": "jvasp-99727",
"created_at": "2022-09-04T14:36:31.999897Z",
"updated_at": "2022-09-04T14:36:31.999916Z",
"structure_string": "Rb2 Y1 Hg1 Br6\n1.0\n7.042647 -0.000000 4.066074\n2.347549 6.639871 4.066074\n-0.000000 -0.000000 8.132148\nRb Y Hg Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.500000 Hg\n0.759421 0.240579 0.240579 Br\n0.240579 0.240579 0.759421 Br\n0.240580 0.759421 0.759420 Br\n0.240580 0.759421 0.240579 Br\n0.759421 0.240579 0.759420 Br\n0.759421 0.759421 0.240578 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Y",
"Hg",
"Br"
],
"chemical_system": "Br-Hg-Rb-Y",
"density": 4.1040186438114565,
"density_atomic": 0.02629657354568499,
"volume": 380.2776807642645,
"volume_molar": 22.900857214487456,
"formula_full": "Rb2 Y1 Hg1 Br6",
"formula_reduced": "Rb2YHgBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-10481",
"created_at": "2022-09-04T14:36:32.000242Z",
"updated_at": "2022-09-04T14:36:32.000262Z",
"structure_string": "K4 Na2 Al2 As4\n1.0\n6.029266 -0.000000 -2.400363\n-1.024763 6.109329 -2.574015\n0.016534 0.033440 8.813911\nK Na Al As\n4 2 2 4\ndirect\n0.324256 0.558766 0.648512 K\n0.175745 0.910255 0.351487 K\n0.675745 0.441234 0.351488 K\n0.824256 0.089746 0.648513 K\n0.250000 0.500000 -0.000000 Na\n0.750001 0.500000 0.000000 Na\n0.250000 -0.000000 0.000000 Al\n0.750001 -0.000000 0.000000 Al\n0.904021 0.701411 0.808041 As\n0.095980 0.298589 0.191959 As\n0.595980 0.893370 0.191959 As\n0.404020 0.106630 0.808041 As\n",
"nsites": 12,
"nelements": 4,
"elements": [
"K",
"Na",
"Al",
"As"
],
"chemical_system": "Al-As-K-Na",
"density": 2.836530680827128,
"density_atomic": 0.0368661248814763,
"volume": 325.5020710362076,
"volume_molar": 16.33516074542968,
"formula_full": "K4 Na2 Al2 As4",
"formula_reduced": "K2NaAlAs2",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 0.5852118833333331,
"spacegroup": 72
},
{
"id": "jvasp-91267",
"created_at": "2022-09-04T14:36:09.188389Z",
"updated_at": "2022-09-04T14:36:09.188413Z",
"structure_string": "Ba1 Sm2 Ni1 O5\n1.0\n3.638036 0.000000 -1.067852\n-0.751969 5.253537 -2.561861\n0.021092 0.015217 6.802946\nBa Sm Ni O\n1 2 1 5\ndirect\n0.000000 0.000000 0.000000 Ba\n0.798427 0.298428 0.596854 Sm\n0.201574 0.701574 0.403148 Sm\n0.499999 0.500000 0.000000 Ni\n-0.000000 0.500000 0.000000 O\n0.353590 0.595386 0.707182 O\n0.646410 0.404618 0.292820 O\n0.646410 0.888204 0.292820 O\n0.353592 0.111798 0.707182 O\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Ba",
"Sm",
"Ni",
"O"
],
"chemical_system": "Ba-Ni-O-Sm",
"density": 7.350258137797379,
"density_atomic": 0.06907452200794205,
"volume": 130.29406123092966,
"volume_molar": 8.718324188052415,
"formula_full": "Ba1 Sm2 Ni1 O5",
"formula_reduced": "BaSm2NiO5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 1.77315818,
"spacegroup": 71
},
{
"id": "jvasp-95127",
"created_at": "2022-09-04T14:36:20.902109Z",
"updated_at": "2022-09-04T14:36:20.902135Z",
"structure_string": "Nd4 Al4 Ge8 O28\n1.0\n6.605615 0.000000 0.000000\n0.000000 7.232426 -0.856276\n0.000000 0.022752 11.467283\nNd Al Ge O\n4 4 8 28\ndirect\n0.351797 0.261570 0.025765 Nd\n0.148203 0.761570 0.525765 Nd\n0.851796 0.238430 0.474235 Nd\n0.648203 0.738430 0.974234 Nd\n0.601733 0.017017 0.229876 Al\n0.398266 0.982984 0.770123 Al\n0.101734 0.482983 0.270123 Al\n0.898266 0.517017 0.729876 Al\n0.410806 0.419494 0.720554 Ge\n0.342361 0.241495 0.451283 Ge\n0.157639 0.741496 0.951283 Ge\n0.589194 0.580506 0.279445 Ge\n0.089194 0.919495 0.220554 Ge\n0.910805 0.080506 0.779445 Ge\n0.657638 0.758505 0.548716 Ge\n0.842361 0.258505 0.048716 Ge\n0.659657 0.088415 0.084085 O\n0.551662 0.160590 0.365014 O\n0.051663 0.339410 0.134985 O\n0.448337 0.839410 0.634985 O\n0.948337 0.660590 0.865014 O\n0.159658 0.411585 0.415915 O\n0.379374 0.230442 0.803622 O\n0.500364 0.326189 0.573736 O\n0.879374 0.269558 0.696377 O\n0.620625 0.769558 0.196377 O\n0.120625 0.730443 0.303622 O\n0.181674 0.528455 0.686613 O\n0.681674 0.971546 0.813386 O\n0.818325 0.471545 0.313386 O\n0.318325 0.028455 0.186613 O\n0.617802 0.555674 0.777238 O\n0.340342 0.911585 0.915915 O\n0.117802 0.944326 0.722762 O\n0.882197 0.055674 0.277238 O\n0.173683 0.068556 0.475968 O\n0.673682 0.431444 0.024032 O\n0.826317 0.931444 0.524031 O\n0.326317 0.568556 0.975968 O\n-0.000364 0.826189 0.073736 O\n0.499635 0.673811 0.426264 O\n0.000364 0.173811 0.926264 O\n0.382198 0.444326 0.222762 O\n0.840341 0.588416 0.584084 O\n",
"nsites": 44,
"nelements": 4,
"elements": [
"Nd",
"Al",
"Ge",
"O"
],
"chemical_system": "Al-Ge-Nd-O",
"density": 5.193970186513245,
"density_atomic": 0.0802958101344408,
"volume": 547.9737974662684,
"volume_molar": 7.499943957121817,
"formula_full": "Nd4 Al4 Ge8 O28",
"formula_reduced": "NdAlGe2O7",
"formula_anonymous": "ABC2D7",
"energy_above_hull": 2.16176279090909,
"spacegroup": 14
},
{
"id": "jvasp-100127",
"created_at": "2022-09-04T14:36:20.773730Z",
"updated_at": "2022-09-04T14:36:20.773749Z",
"structure_string": "Rb2 Li1 Mo1 I6\n1.0\n7.020683 0.000000 4.053394\n2.340227 6.619164 4.053394\n-0.000000 -0.000000 8.106787\nRb Li Mo I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Mo\n0.755237 0.244763 0.244763 I\n0.244763 0.244763 0.755237 I\n0.244763 0.755236 0.755237 I\n0.244763 0.755236 0.244763 I\n0.755237 0.244763 0.755237 I\n0.755237 0.755236 0.244763 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Li",
"Mo",
"I"
],
"chemical_system": "I-Li-Mo-Rb",
"density": 4.563103381716888,
"density_atomic": 0.026544144445397676,
"volume": 376.7309216000683,
"volume_molar": 22.687266385201358,
"formula_full": "Rb2 Li1 Mo1 I6",
"formula_reduced": "Rb2LiMoI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.254345355,
"spacegroup": 225
},
{
"id": "jvasp-88807",
"created_at": "2022-09-04T14:36:20.722688Z",
"updated_at": "2022-09-04T14:36:20.722711Z",
"structure_string": "Sr2 Ta2 N2 O4\n1.0\n4.974272 -0.164376 -2.997126\n-3.349974 4.742994 0.187714\n-0.115975 0.164262 5.806319\nSr Ta N O\n2 2 2 4\ndirect\n0.499990 0.255515 0.755492 Sr\n0.500022 0.755513 0.255519 Sr\n-0.000007 0.017005 0.017010 Ta\n-0.000002 0.517007 0.517015 Ta\n-0.000015 0.240416 0.240399 N\n0.000014 0.740415 0.740427 N\n0.102463 0.294751 0.794755 O\n0.499994 0.794750 0.692298 O\n0.897532 0.692304 0.192304 O\n0.500000 0.192317 0.294770 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Sr",
"Ta",
"N",
"O"
],
"chemical_system": "N-O-Sr-Ta",
"density": 7.817342282074271,
"density_atomic": 0.07482695390185229,
"volume": 133.64168228893328,
"volume_molar": 8.048090221471554,
"formula_full": "Sr2 Ta2 N2 O4",
"formula_reduced": "SrTaNO2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 2.910081152,
"spacegroup": 108
},
{
"id": "jvasp-101048",
"created_at": "2022-09-04T14:36:35.492811Z",
"updated_at": "2022-09-04T14:36:35.492833Z",
"structure_string": "Y2 P2 Ru4 C2\n1.0\n5.846705 -0.006364 0.000000\n-4.620358 3.582777 0.000000\n-0.000000 -0.000000 7.069793\nY P Ru C\n2 2 4 2\ndirect\n0.543690 0.456311 0.250000 Y\n0.456310 0.543691 0.750000 Y\n0.268238 0.731763 0.250000 P\n0.731762 0.268239 0.750000 P\n0.834791 0.165210 0.053114 Ru\n0.165209 0.834792 0.946885 Ru\n0.165209 0.834792 0.553114 Ru\n0.834791 0.165210 0.446886 Ru\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Y",
"P",
"Ru",
"C"
],
"chemical_system": "C-P-Ru-Y",
"density": 7.501314311778098,
"density_atomic": 0.06761956784050993,
"volume": 147.88618619371212,
"volume_molar": 8.90591429718103,
"formula_full": "Y2 P2 Ru4 C2",
"formula_reduced": "YPRu2C",
"formula_anonymous": "ABCD2",
"energy_above_hull": 4.314450390000001,
"spacegroup": 63
},
{
"id": "jvasp-107853",
"created_at": "2022-09-04T14:36:36.070505Z",
"updated_at": "2022-09-04T14:36:36.070528Z",
"structure_string": "Rb2 Ag1 Au1 F6\n1.0\n5.416100 -0.000000 3.126987\n1.805367 5.106348 3.126987\n-0.000000 -0.000000 6.253973\nRb Ag Au F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Au\n0.751080 0.248921 0.248921 F\n0.248921 0.248921 0.751079 F\n0.248921 0.751080 0.751079 F\n0.248921 0.751080 0.248921 F\n0.751080 0.248921 0.751079 F\n0.751080 0.751080 0.248921 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Ag",
"Au",
"F"
],
"chemical_system": "Ag-Au-F-Rb",
"density": 5.662026612517222,
"density_atomic": 0.05781584998774943,
"volume": 172.96295050784335,
"volume_molar": 10.416072342231462,
"formula_full": "Rb2 Ag1 Au1 F6",
"formula_reduced": "Rb2AgAuF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-91256",
"created_at": "2022-09-04T14:36:12.007244Z",
"updated_at": "2022-09-04T14:36:12.007265Z",
"structure_string": "Ba1 Pr2 Ni1 O5\n1.0\n3.686607 -0.000025 -1.076480\n-0.764082 5.348747 -2.616488\n0.022090 0.022501 6.926289\nBa Pr Ni O\n1 2 1 5\ndirect\n0.000000 0.000000 0.000000 Ba\n0.201345 0.701346 0.402689 Pr\n0.798657 0.298656 0.597311 Pr\n0.500001 0.500001 0.000000 Ni\n1.000000 0.500001 0.000001 O\n0.356669 0.599727 0.713323 O\n0.643333 0.400274 0.286677 O\n0.643347 0.886408 0.286679 O\n0.356654 0.113593 0.713321 O\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Ba",
"Pr",
"Ni",
"O"
],
"chemical_system": "Ba-Ni-O-Pr",
"density": 6.764287278673309,
"density_atomic": 0.06572210831776766,
"volume": 136.94022042757402,
"volume_molar": 9.1630364791142,
"formula_full": "Ba1 Pr2 Ni1 O5",
"formula_reduced": "BaPr2NiO5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 1.8254550633333333,
"spacegroup": 71
},
{
"id": "jvasp-43192",
"created_at": "2022-09-04T14:36:20.773441Z",
"updated_at": "2022-09-04T14:36:20.773470Z",
"structure_string": "Li4 Co6 W2 O16\n1.0\n5.740260 0.000004 0.000475\n-2.870126 4.971203 -0.000948\n-0.000820 0.001419 9.310285\nLi Co W O\n4 6 2 16\ndirect\n0.333337 0.666679 0.901020 Li\n-0.000060 -0.000013 0.995898 Li\n0.000061 0.000048 0.495898 Li\n0.666662 0.333340 0.401020 Li\n0.831606 0.663166 0.714462 Co\n0.336895 0.168456 0.714464 Co\n0.831610 0.168461 0.714464 Co\n0.168389 0.336851 0.214465 Co\n0.168392 0.831559 0.214463 Co\n0.663104 0.831560 0.214464 Co\n0.333355 0.666689 0.491848 W\n0.666644 0.333332 0.991848 W\n0.335407 0.167714 0.095109 O\n0.832235 0.664542 0.095121 O\n0.666700 0.333358 0.612466 O\n0.518882 0.037717 0.838812 O\n0.518878 0.481179 0.838813 O\n0.664591 0.832305 0.595108 O\n0.481118 0.518835 0.338812 O\n0.037687 0.518854 0.338825 O\n0.167759 0.335482 0.595124 O\n0.000044 0.000033 0.807487 O\n0.999955 0.999986 0.307487 O\n0.333298 0.666657 0.112466 O\n0.962312 0.481168 0.838824 O\n0.167763 0.832309 0.595121 O\n0.481120 0.962300 0.338813 O\n0.832240 0.167720 0.095124 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Co",
"W",
"O"
],
"chemical_system": "Co-Li-O-W",
"density": 6.281645751130838,
"density_atomic": 0.1053905829298303,
"volume": 265.6783862619165,
"volume_molar": 5.7141165677103976,
"formula_full": "Li4 Co6 W2 O16",
"formula_reduced": "Li2Co3WO8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 3.269377907142857,
"spacegroup": 186
}
]
}