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=-created_at&page=3820",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=3818",
"results": [
{
"id": "jvasp-72304",
"created_at": "2022-09-04T14:36:08.058502Z",
"updated_at": "2022-09-04T14:36:08.058520Z",
"structure_string": "Be1 Cd2 Ru1\n1.0\n3.910236 0.000000 0.000000\n0.000000 3.910236 0.000000\n0.000000 0.000000 4.124513\nBe Cd Ru\n1 2 1\ndirect\n0.000000 0.000000 0.500000 Be\n0.000000 0.500001 0.000000 Cd\n0.500001 0.000000 0.000000 Cd\n0.500001 0.500001 0.500000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cd",
"Ru"
],
"chemical_system": "Be-Cd-Ru",
"density": 8.818425531577462,
"density_atomic": 0.06342805220758878,
"volume": 63.06357929625064,
"volume_molar": 9.494443783786078,
"formula_full": "Be1 Cd2 Ru1",
"formula_reduced": "BeCd2Ru",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7095590250000001,
"spacegroup": 123
},
{
"id": "jvasp-19889",
"created_at": "2022-09-04T14:36:08.056660Z",
"updated_at": "2022-09-04T14:36:08.056676Z",
"structure_string": "Nb1 C1\n1.0\n2.766375 -0.000000 1.597167\n0.922125 2.608163 1.597167\n-0.000000 -0.000000 3.194335\nNb C\n1 1\ndirect\n0.000000 0.000000 0.000000 Nb\n0.500000 0.499999 0.500000 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Nb",
"C"
],
"chemical_system": "C-Nb",
"density": 7.55908191497269,
"density_atomic": 0.08677682475354302,
"volume": 23.047628277253157,
"volume_molar": 6.939803083488742,
"formula_full": "Nb1 C1",
"formula_reduced": "NbC",
"formula_anonymous": "AB",
"energy_above_hull": 3.5720696999999992,
"spacegroup": 225
},
{
"id": "jvasp-86815",
"created_at": "2022-09-04T14:36:08.053688Z",
"updated_at": "2022-09-04T14:36:08.053718Z",
"structure_string": "Li8 Zn4 Ge4\n1.0\n4.301202 0.000000 0.000000\n-2.150601 3.724951 0.000000\n-0.000000 -0.000000 16.393713\nLi Zn Ge\n8 4 4\ndirect\n0.333333 0.666667 0.209146 Li\n0.333333 0.666667 0.040825 Li\n0.666667 0.333333 0.790854 Li\n0.666667 0.333333 0.459147 Li\n0.666667 0.333333 0.290856 Li\n0.333333 0.666667 0.709144 Li\n0.666667 0.333333 0.959174 Li\n0.333333 0.666667 0.540852 Li\n0.000000 0.000000 0.124838 Zn\n0.000000 0.000000 0.625004 Zn\n0.000000 0.000000 0.374996 Zn\n0.000000 0.000000 0.875162 Zn\n0.666667 0.333333 0.625003 Ge\n0.666667 0.333333 0.125018 Ge\n0.333333 0.666667 0.874982 Ge\n0.333333 0.666667 0.374997 Ge\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Li",
"Zn",
"Ge"
],
"chemical_system": "Ge-Li-Zn",
"density": 3.842091948527679,
"density_atomic": 0.06091612254218619,
"volume": 262.6562448868858,
"volume_molar": 9.885955488761605,
"formula_full": "Li8 Zn4 Ge4",
"formula_reduced": "Li2ZnGe",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.14596,
"spacegroup": 194
},
{
"id": "jvasp-12174",
"created_at": "2022-09-04T14:36:08.047355Z",
"updated_at": "2022-09-04T14:36:08.047380Z",
"structure_string": "Co1 Te1 O4\n1.0\n4.751832 -0.234730 -0.143317\n7.727869 5.540252 -0.262251\n7.727852 3.918619 2.393001\nCo Te O\n1 1 4\ndirect\n0.500000 0.499999 0.499999 Co\n0.499999 0.000001 0.500000 Te\n0.202540 -0.000005 0.250050 O\n0.286045 0.499989 0.228269 O\n0.797459 0.000004 0.749949 O\n0.713956 0.500013 0.771728 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Co",
"Te",
"O"
],
"chemical_system": "Co-O-Te",
"density": 5.584501070222484,
"density_atomic": 0.08054255732722793,
"volume": 74.4947788983559,
"volume_molar": 7.476967406849616,
"formula_full": "Co1 Te1 O4",
"formula_reduced": "CoTeO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.4176471111111115,
"spacegroup": 10
},
{
"id": "jvasp-52786",
"created_at": "2022-09-04T14:36:08.041121Z",
"updated_at": "2022-09-04T14:36:08.041143Z",
"structure_string": "Fe4 O4 F4\n1.0\n4.632237 -0.000000 0.000000\n0.000000 4.632237 0.000000\n0.000000 0.000000 5.960878\nFe O F\n4 4 4\ndirect\n0.030721 0.030721 0.000000 Fe\n0.469279 0.530721 0.250000 Fe\n0.969280 0.969280 0.500000 Fe\n0.530721 0.469279 0.750000 Fe\n0.185119 0.814882 0.250000 O\n0.685119 0.685119 0.500000 O\n0.814882 0.185119 0.750000 O\n0.314881 0.314881 0.000000 O\n0.778935 0.221065 0.250000 F\n0.278935 0.278935 0.500000 F\n0.221065 0.778935 0.750000 F\n0.721066 0.721066 0.000000 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-O",
"density": 4.7174558050044775,
"density_atomic": 0.09381871286189136,
"volume": 127.90625275007726,
"volume_molar": 6.418912151209186,
"formula_full": "Fe4 O4 F4",
"formula_reduced": "FeOF",
"formula_anonymous": "ABC",
"energy_above_hull": 1.1192897608333334,
"spacegroup": 92
},
{
"id": "jvasp-67671",
"created_at": "2022-09-04T14:36:08.039249Z",
"updated_at": "2022-09-04T14:36:08.039281Z",
"structure_string": "Mn1 Be1 Tc2\n1.0\n2.861862 0.000000 0.000000\n0.000000 2.861862 0.000000\n-0.000000 0.000000 5.834289\nMn Be Tc\n1 1 2\ndirect\n0.500000 0.500000 0.723041 Mn\n0.000000 0.000000 0.524029 Be\n0.000000 0.000000 0.967770 Tc\n0.500000 0.500000 0.285161 Tc\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Be",
"Tc"
],
"chemical_system": "Be-Mn-Tc",
"density": 9.033457055846528,
"density_atomic": 0.08370948636797722,
"volume": 47.78430944393163,
"volume_molar": 7.194095939768841,
"formula_full": "Mn1 Be1 Tc2",
"formula_reduced": "MnBeTc2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.237194085344827,
"spacegroup": 99
},
{
"id": "jvasp-70706",
"created_at": "2022-09-04T14:36:08.038722Z",
"updated_at": "2022-09-04T14:36:08.038742Z",
"structure_string": "Be2 Pt1 W1\n1.0\n2.768793 0.000000 0.000000\n0.000000 2.768793 0.000000\n0.000000 0.000000 6.191231\nBe Pt W\n2 1 1\ndirect\n0.000000 0.000000 0.773913 Be\n0.000000 0.000000 0.226087 Be\n0.499999 0.499999 0.000000 Pt\n0.499999 0.499999 0.500000 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Pt",
"W"
],
"chemical_system": "Be-Pt-W",
"density": 13.887533801395524,
"density_atomic": 0.08427562975436613,
"volume": 47.46330595996251,
"volume_molar": 7.14576773564603,
"formula_full": "Be2 Pt1 W1",
"formula_reduced": "Be2PtW",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.4743433999999995,
"spacegroup": 123
},
{
"id": "jvasp-98304",
"created_at": "2022-09-04T14:36:08.037436Z",
"updated_at": "2022-09-04T14:36:08.037461Z",
"structure_string": "Sr2 H32 O20\n1.0\n6.105953 -0.023696 -0.182474\n-0.003797 6.247668 0.263155\n-0.365583 0.474831 11.326056\nSr H O\n2 32 20\ndirect\n0.971984 0.013303 0.502409 Sr\n0.019377 0.940993 -0.020006 Sr\n0.268883 0.380802 0.605837 H\n0.035310 0.421216 0.652850 H\n0.370915 0.716399 0.604519 H\n0.432164 -0.054588 0.647707 H\n0.737828 0.178377 0.713931 H\n0.597782 0.281098 0.600886 H\n0.068823 0.555416 0.163699 H\n0.721822 0.394902 0.098299 H\n0.032059 0.228208 0.156245 H\n0.741310 0.831868 0.212259 H\n0.620186 0.726167 0.106103 H\n0.385595 0.268541 0.103197 H\n0.432277 0.023545 0.128920 H\n0.709069 0.608297 0.602956 H\n0.800555 0.722871 0.714899 H\n0.184993 0.757433 0.224598 H\n0.561801 0.922785 0.842925 H\n0.626609 0.679865 0.887064 H\n0.026745 0.351867 0.304636 H\n0.229315 0.425401 0.396771 H\n0.922175 0.606971 0.374315 H\n0.718488 0.213131 0.282484 H\n0.575602 0.309102 0.379343 H\n0.392221 0.001471 0.346668 H\n0.675020 0.658422 0.388194 H\n0.348723 0.758089 0.391778 H\n0.979048 0.402985 0.849499 H\n0.742338 0.348306 0.894389 H\n0.206688 0.709207 0.781078 H\n0.300166 0.571070 0.897226 H\n0.403209 0.227036 0.894697 H\n0.267971 0.179032 0.775293 H\n0.335057 0.107814 0.851356 O\n0.158362 0.689894 0.149212 O\n0.669656 0.141354 0.636888 O\n0.307487 0.843919 0.640581 O\n0.142537 0.304871 0.646790 O\n0.847954 0.671437 0.640219 O\n0.688054 0.821532 0.852277 O\n0.917641 0.326658 0.175070 O\n0.162032 0.641662 0.858652 O\n0.536619 0.454792 0.940157 O\n0.271575 0.897490 0.362280 O\n0.637726 0.171080 0.354581 O\n0.817801 0.730803 0.364823 O\n0.072304 0.370844 0.390828 O\n0.567480 0.465962 0.070836 O\n0.480028 0.502723 0.557410 O\n0.464198 0.526299 0.424449 O\n0.681661 0.866825 0.128899 O\n0.874342 0.282094 0.860497 O\n0.308742 0.126862 0.110805 O\n",
"nsites": 54,
"nelements": 3,
"elements": [
"Sr",
"H",
"O"
],
"chemical_system": "H-O-Sr",
"density": 2.0327901587338926,
"density_atomic": 0.12532263042682162,
"volume": 430.8878597272316,
"volume_molar": 4.805309894541711,
"formula_full": "Sr2 H32 O20",
"formula_reduced": "Sr(H8O5)2",
"formula_anonymous": "AB10C16",
"energy_above_hull": 3.0292326411111112,
"spacegroup": 1
},
{
"id": "jvasp-86671",
"created_at": "2022-09-04T14:36:08.036165Z",
"updated_at": "2022-09-04T14:36:08.036198Z",
"structure_string": "Dy10 Bi2 Au4\n1.0\n6.600231 -0.000000 -3.369087\n-1.719750 6.372245 -3.369087\n0.938587 1.225474 9.988401\nDy Bi Au\n10 2 4\ndirect\n0.503249 0.326428 0.329676 Dy\n0.673572 0.173571 0.670323 Dy\n-0.003249 0.496751 0.670323 Dy\n0.826428 0.003249 0.329677 Dy\n0.000000 0.000000 0.000000 Dy\n0.173572 -0.003249 0.670323 Dy\n0.326428 0.826427 0.329676 Dy\n0.496751 0.673571 0.670322 Dy\n0.003249 0.503248 0.329677 Dy\n0.500000 0.500000 -0.000000 Dy\n0.750000 0.749999 0.499999 Bi\n0.250000 0.250000 0.500000 Bi\n0.872016 0.372016 -0.000001 Au\n0.127984 0.627984 -0.000000 Au\n0.372016 0.127984 -0.000000 Au\n0.627984 0.872015 -0.000001 Au\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Dy",
"Bi",
"Au"
],
"chemical_system": "Au-Bi-Dy",
"density": 9.904628452593244,
"density_atomic": 0.0337128705562121,
"volume": 474.5961923747179,
"volume_molar": 17.863031716503684,
"formula_full": "Dy10 Bi2 Au4",
"formula_reduced": "Dy5BiAu2",
"formula_anonymous": "AB2C5",
"energy_above_hull": 1.2391502425,
"spacegroup": 140
},
{
"id": "jvasp-65737",
"created_at": "2022-09-04T14:36:08.035732Z",
"updated_at": "2022-09-04T14:36:08.035753Z",
"structure_string": "Ba1 Zn4 Br1\n1.0\n0.000000 4.216839 4.216839\n4.216839 0.000000 4.216839\n4.216839 4.216839 -0.000000\nBa Zn Br\n1 4 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.115973 0.628009 0.628009 Zn\n0.628009 0.628009 0.628009 Zn\n0.628009 0.115973 0.628009 Zn\n0.628009 0.628009 0.115973 Zn\n0.000000 0.000000 0.000000 Br\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"Br"
],
"chemical_system": "Ba-Br-Zn",
"density": 5.302405679465352,
"density_atomic": 0.040009230177981046,
"volume": 149.96539481787082,
"volume_molar": 15.051878612036546,
"formula_full": "Ba1 Zn4 Br1",
"formula_reduced": "BaZn4Br",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-71039",
"created_at": "2022-09-04T14:36:08.029612Z",
"updated_at": "2022-09-04T14:36:08.029631Z",
"structure_string": "Li1 Mg2 Be1\n1.0\n3.118974 0.000000 -0.000000\n0.000000 3.118974 0.000000\n0.000000 0.000000 6.869334\nLi Mg Be\n1 2 1\ndirect\n0.499999 0.499999 0.702922 Li\n0.000000 0.000000 0.969057 Mg\n0.499999 0.499999 0.299305 Mg\n0.000000 0.000000 0.528715 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Mg",
"Be"
],
"chemical_system": "Be-Li-Mg",
"density": 1.6043380431358842,
"density_atomic": 0.05985795139852972,
"volume": 66.82487299587488,
"volume_molar": 10.060719786257037,
"formula_full": "Li1 Mg2 Be1",
"formula_reduced": "LiMg2Be",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2453285499999999,
"spacegroup": 99
},
{
"id": "jvasp-69172",
"created_at": "2022-09-04T14:36:08.022012Z",
"updated_at": "2022-09-04T14:36:08.022040Z",
"structure_string": "Ba1 Sn1 Sb2\n1.0\n4.318026 0.000000 0.000000\n0.000000 4.318026 0.000000\n0.000000 -0.000000 7.069465\nBa Sn Sb\n1 1 2\ndirect\n0.500001 0.500001 0.764525 Ba\n0.000000 0.000000 0.439733 Sn\n0.000000 0.000000 0.029624 Sb\n0.500001 0.500001 0.266120 Sb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Sn",
"Sb"
],
"chemical_system": "Ba-Sb-Sn",
"density": 6.293280534106698,
"density_atomic": 0.030346103633143447,
"volume": 131.81263889283218,
"volume_molar": 19.84485663399215,
"formula_full": "Ba1 Sn1 Sb2",
"formula_reduced": "BaSnSb2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7547749675000001,
"spacegroup": 99
}
]
}