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=volume_molar&page=3571",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume_molar&page=3569",
"results": [
{
"id": "jvasp-77046",
"created_at": "2022-09-04T14:37:08.214773Z",
"updated_at": "2022-09-04T14:37:08.214799Z",
"structure_string": "Ca2 Hg1 Au1\n1.0\n-11.973748 2.523342 -2.792451\n-8.830042 0.373072 0.706892\n-7.330174 4.615342 -1.890957\nCa Hg Au\n2 1 1\ndirect\n0.751165 -0.000510 -0.000511 Ca\n0.248835 0.000511 0.000511 Ca\n0.500000 0.000000 -0.000000 Hg\n0.000000 0.000000 0.000000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Hg",
"Au"
],
"chemical_system": "Au-Ca-Hg",
"density": 8.055839129759839,
"density_atomic": 0.040621411571940325,
"volume": 98.47023639038292,
"volume_molar": 14.825040605334006,
"formula_full": "Ca2 Hg1 Au1",
"formula_reduced": "Ca2HgAu",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 71
},
{
"id": "jvasp-34954",
"created_at": "2022-09-04T14:38:29.114122Z",
"updated_at": "2022-09-04T14:38:29.114147Z",
"structure_string": "Na6 Ho2 Cl12\n1.0\n0.000000 6.740552 -0.017965\n7.251460 0.000000 0.000000\n0.000000 -6.575418 -10.055521\nNa Ho Cl\n6 2 12\ndirect\n0.499999 0.500000 0.500000 Na\n0.500000 0.000000 -0.000000 Na\n0.289862 0.913207 0.257088 Na\n0.710137 0.413207 0.242911 Na\n0.710137 0.086793 0.742911 Na\n0.289862 0.586793 0.757088 Na\n0.000000 0.500000 0.000000 Ho\n-0.000000 0.000000 0.500000 Ho\n0.386731 0.820574 0.568551 Cl\n0.613268 0.320574 0.931448 Cl\n0.753666 0.692559 0.421258 Cl\n0.246333 0.192559 0.078741 Cl\n0.246333 0.307441 0.578741 Cl\n0.905225 0.061899 0.258929 Cl\n0.094774 0.938101 0.741071 Cl\n0.905225 0.438101 0.758929 Cl\n0.386731 0.679426 0.068551 Cl\n0.094774 0.561899 0.241071 Cl\n0.753665 0.807441 0.921258 Cl\n0.613268 0.179426 0.431449 Cl\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Na",
"Ho",
"Cl"
],
"chemical_system": "Cl-Ho-Na",
"density": 3.012542776516516,
"density_atomic": 0.04062078055385776,
"volume": 492.35883031549963,
"volume_molar": 14.82527090294447,
"formula_full": "Na6 Ho2 Cl12",
"formula_reduced": "Na3HoCl6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 14
},
{
"id": "jvasp-3600",
"created_at": "2022-09-04T14:36:02.530415Z",
"updated_at": "2022-09-04T14:36:02.530442Z",
"structure_string": "Zr2 I2 N2\n1.0\n3.763524 0.000000 0.000000\n0.000000 4.128624 0.000000\n0.000000 0.000000 9.506183\nZr I N\n2 2 2\ndirect\n0.000000 0.500000 0.909712 Zr\n0.499999 0.000000 0.090288 Zr\n0.499999 0.500000 0.667117 I\n0.000000 0.000000 0.332883 I\n0.000000 0.000000 0.974749 N\n0.499999 0.500000 0.025251 N\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Zr",
"I",
"N"
],
"chemical_system": "I-N-Zr",
"density": 5.219319030070595,
"density_atomic": 0.0406204805777089,
"volume": 147.70873989345637,
"volume_molar": 14.825380385343696,
"formula_full": "Zr2 I2 N2",
"formula_reduced": "ZrIN",
"formula_anonymous": "ABC",
"energy_above_hull": 2.1912346750000005,
"spacegroup": 59
},
{
"id": "jvasp-116381",
"created_at": "2022-09-04T14:38:42.778904Z",
"updated_at": "2022-09-04T14:38:42.778933Z",
"structure_string": "Ca1 As1 Au1\n1.0\n2.980910 -0.000000 -0.000000\n0.000000 2.980910 -0.000000\n-0.000000 0.000000 8.311484\nCa As Au\n1 1 1\ndirect\n0.000000 0.000000 0.006892 Ca\n0.000000 0.000000 0.349600 As\n0.000000 0.000000 0.667215 Au\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"As",
"Au"
],
"chemical_system": "As-Au-Ca",
"density": 7.014234742037957,
"density_atomic": 0.040620470889744804,
"volume": 73.85438756096231,
"volume_molar": 14.82538392119027,
"formula_full": "Ca1 As1 Au1",
"formula_reduced": "CaAsAu",
"formula_anonymous": "ABC",
"energy_above_hull": 0.7630232466666669,
"spacegroup": 99
},
{
"id": "jvasp-19903",
"created_at": "2022-09-04T14:35:55.013692Z",
"updated_at": "2022-09-04T14:35:55.013708Z",
"structure_string": "Y1 As1\n1.0\n3.562876 0.000000 2.057028\n1.187625 3.359112 2.057028\n-0.000000 -0.000000 4.114056\nY As\n1 1\ndirect\n0.000000 0.000000 0.000000 Y\n0.500001 0.500000 0.500000 As\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Y",
"As"
],
"chemical_system": "As-Y",
"density": 5.525102989995549,
"density_atomic": 0.040619502935251066,
"volume": 49.23743166399823,
"volume_molar": 14.825737207073917,
"formula_full": "Y1 As1",
"formula_reduced": "YAs",
"formula_anonymous": "AB",
"energy_above_hull": 0.9182036,
"spacegroup": 225
},
{
"id": "jvasp-56886",
"created_at": "2022-09-04T14:38:34.664589Z",
"updated_at": "2022-09-04T14:38:34.664614Z",
"structure_string": "Pr4 Co4 I2\n1.0\n2.001702 -3.467050 -0.000000\n2.001702 3.467050 -0.000000\n-0.000000 0.000000 17.737348\nPr Co I\n4 4 2\ndirect\n0.000000 0.000000 0.893865 Pr\n0.000000 0.000000 0.606135 Pr\n0.000000 0.000000 0.106135 Pr\n0.000000 0.000000 0.393865 Pr\n0.333332 0.666666 0.999866 Co\n0.666666 0.333332 0.000134 Co\n0.333332 0.666666 0.500134 Co\n0.666666 0.333332 0.499866 Co\n0.333332 0.666666 0.250000 I\n0.666666 0.333332 0.750000 I\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Pr",
"Co",
"I"
],
"chemical_system": "Co-I-Pr",
"density": 7.103466280892413,
"density_atomic": 0.04061830436469409,
"volume": 246.19442284479308,
"volume_molar": 14.826174686983038,
"formula_full": "Pr4 Co4 I2",
"formula_reduced": "Pr2Co2I",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.924985555,
"spacegroup": 194
},
{
"id": "jvasp-20422",
"created_at": "2022-09-04T14:38:34.993630Z",
"updated_at": "2022-09-04T14:38:34.993653Z",
"structure_string": "Hf8 Sb16\n1.0\n3.908643 0.000000 0.000000\n0.000000 9.976902 0.000000\n0.000000 0.000000 15.152379\nHf Sb\n8 16\ndirect\n0.500000 0.522023 0.252300 Hf\n0.500000 0.477977 0.747700 Hf\n0.000000 0.022023 0.247700 Hf\n0.000000 0.977977 0.752300 Hf\n0.000000 0.833577 0.493792 Hf\n0.000000 0.166422 0.506208 Hf\n0.500000 0.333577 0.006208 Hf\n0.500000 0.666422 0.993792 Hf\n0.000000 0.341252 0.345474 Sb\n0.000000 0.658747 0.654526 Sb\n0.500000 0.619552 0.443140 Sb\n0.500000 0.380447 0.556860 Sb\n0.000000 0.119552 0.056860 Sb\n0.000000 0.880447 0.943140 Sb\n0.500000 0.766924 0.801846 Sb\n0.500000 0.986780 0.605096 Sb\n0.000000 0.266924 0.698154 Sb\n0.000000 0.733076 0.301846 Sb\n0.500000 0.158747 0.845474 Sb\n0.500000 0.013220 0.394904 Sb\n0.000000 0.486780 0.894904 Sb\n0.000000 0.513220 0.105096 Sb\n0.500000 0.233076 0.198154 Sb\n0.500000 0.841252 0.154526 Sb\n",
"nsites": 24,
"nelements": 2,
"elements": [
"Hf",
"Sb"
],
"chemical_system": "Hf-Sb",
"density": 9.487663873377713,
"density_atomic": 0.040617080648889164,
"volume": 590.8844165208701,
"volume_molar": 14.826621371579789,
"formula_full": "Hf8 Sb16",
"formula_reduced": "HfSb2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.442705066666667,
"spacegroup": 58
},
{
"id": "jvasp-91629",
"created_at": "2022-09-04T14:35:49.181565Z",
"updated_at": "2022-09-04T14:35:49.181583Z",
"structure_string": "Li2 Pr2 Sn4\n1.0\n-4.540780 0.000000 0.000000\n0.000000 -0.000000 -4.536187\n2.270390 -9.562340 -0.000000\nLi Pr Sn\n2 2 4\ndirect\n0.675817 0.750000 0.351632 Li\n0.324183 0.250000 0.648367 Li\n0.893650 0.750000 0.787299 Pr\n0.106350 0.250000 0.212701 Pr\n0.544694 0.750000 0.089389 Sn\n0.455305 0.250000 0.910611 Sn\n0.250122 0.750000 0.500245 Sn\n0.749877 0.250000 0.499755 Sn\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Li",
"Pr",
"Sn"
],
"chemical_system": "Li-Pr-Sn",
"density": 6.496166869083551,
"density_atomic": 0.040616677530952966,
"volume": 196.96342700368334,
"volume_molar": 14.826768524852078,
"formula_full": "Li2 Pr2 Sn4",
"formula_reduced": "LiPrSn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6518058125000001,
"spacegroup": 63
},
{
"id": "jvasp-9106",
"created_at": "2022-09-04T14:37:05.301923Z",
"updated_at": "2022-09-04T14:37:05.301945Z",
"structure_string": "K3 Ga9\n1.0\n5.879101 -0.000000 -2.295969\n-0.896646 5.810324 -2.295969\n-0.007470 -0.008711 8.655924\nK Ga\n3 9\ndirect\n0.127237 0.627237 0.254473 K\n0.372762 0.872763 0.745526 K\n0.000000 0.000000 0.000000 K\n0.778105 0.983599 0.556209 Ga\n0.016400 0.221895 0.443790 Ga\n0.700074 0.393828 0.787655 Ga\n0.606172 0.299925 0.212344 Ga\n0.606171 0.912419 0.212344 Ga\n0.087580 0.393828 0.787655 Ga\n0.778105 0.572610 0.556209 Ga\n0.427390 0.221895 0.443790 Ga\n0.500000 0.500000 -0.000000 Ga\n",
"nsites": 12,
"nelements": 2,
"elements": [
"K",
"Ga"
],
"chemical_system": "Ga-K",
"density": 4.186110781197298,
"density_atomic": 0.040616461966655304,
"volume": 295.44670852551315,
"volume_molar": 14.826847215161104,
"formula_full": "K3 Ga9",
"formula_reduced": "KGa3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 119
},
{
"id": "jvasp-107993",
"created_at": "2022-09-04T14:36:08.931164Z",
"updated_at": "2022-09-04T14:36:08.931175Z",
"structure_string": "Th1 Bi1 Au2\n1.0\n4.489074 -0.000000 2.591768\n1.496358 4.232340 2.591768\n-0.000000 -0.000000 5.183537\nTh Bi Au\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Th\n0.500000 0.500000 0.500001 Bi\n0.750000 0.750000 0.750001 Au\n0.250000 0.250000 0.250000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Th",
"Bi",
"Au"
],
"chemical_system": "Au-Bi-Th",
"density": 14.078191916798406,
"density_atomic": 0.04061593682873706,
"volume": 98.48350948709061,
"volume_molar": 14.827038916751377,
"formula_full": "Th1 Bi1 Au2",
"formula_reduced": "ThBiAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.12525376,
"spacegroup": 225
},
{
"id": "jvasp-25779",
"created_at": "2022-09-04T14:38:16.711602Z",
"updated_at": "2022-09-04T14:38:16.711621Z",
"structure_string": "Tl4 Bi4 P8 S28\n1.0\n0.000000 9.152283 -0.006683\n12.367546 0.000000 0.000000\n0.000000 -0.068960 -9.571258\nTl Bi P S\n4 4 8 28\ndirect\n0.878321 0.310657 0.881858 Tl\n0.621679 0.810657 0.118142 Tl\n0.121679 0.689344 0.118142 Tl\n0.378321 0.189343 0.881858 Tl\n0.116335 0.361264 0.342720 Bi\n0.883664 0.638736 0.657280 Bi\n0.616335 0.138736 0.342720 Bi\n0.383664 0.861264 0.657280 Bi\n0.021389 0.897516 0.780534 P\n0.201701 0.462013 0.681268 P\n0.478611 0.397516 0.219466 P\n0.298299 0.962013 0.318732 P\n0.701701 0.037988 0.681268 P\n0.978611 0.102484 0.219466 P\n0.521389 0.602484 0.780534 P\n0.798299 0.537988 0.318732 P\n0.072900 0.827493 0.593759 S\n0.612430 0.293603 0.115650 S\n0.076135 0.946234 0.248503 S\n0.351207 0.804168 0.349491 S\n0.112430 0.206397 0.115650 S\n0.423865 0.446234 0.751497 S\n0.422924 0.027818 0.162816 S\n0.186938 0.555936 0.506163 S\n0.707015 0.554011 0.881122 S\n0.292985 0.445989 0.118878 S\n0.387570 0.706397 0.884350 S\n0.427100 0.327493 0.406241 S\n0.148793 0.304168 0.650509 S\n0.887570 0.793603 0.884350 S\n0.851207 0.695832 0.349491 S\n0.923865 0.053766 0.751497 S\n0.813061 0.444064 0.493837 S\n0.576135 0.553766 0.248503 S\n0.922924 0.472183 0.162816 S\n0.207015 0.945989 0.881122 S\n0.686938 0.944064 0.506163 S\n0.577075 0.972183 0.837184 S\n0.792985 0.054011 0.118878 S\n0.077076 0.527818 0.837184 S\n0.648793 0.195832 0.650509 S\n0.572900 0.672507 0.593759 S\n0.313062 0.055936 0.493837 S\n0.927100 0.172507 0.406240 S\n",
"nsites": 44,
"nelements": 4,
"elements": [
"Tl",
"Bi",
"P",
"S"
],
"chemical_system": "Bi-P-S-Tl",
"density": 4.290202407429409,
"density_atomic": 0.04061331070316869,
"volume": 1083.3886535767467,
"volume_molar": 14.827997658241015,
"formula_full": "Tl4 Bi4 P8 S28",
"formula_reduced": "TlBiP2S7",
"formula_anonymous": "ABC2D7",
"energy_above_hull": 2.108026172727273,
"spacegroup": 14
},
{
"id": "jvasp-1930",
"created_at": "2022-09-04T14:36:35.053034Z",
"updated_at": "2022-09-04T14:36:35.053062Z",
"structure_string": "Fe1 Br2\n1.0\n1.850875 -3.205808 0.000000\n1.850875 3.205808 0.000000\n-0.000000 0.000000 6.224605\nFe Br\n1 2\ndirect\n0.000000 0.000000 0.000000 Fe\n0.666666 0.333332 0.758374 Br\n0.333332 0.666666 0.241625 Br\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Fe",
"Br"
],
"chemical_system": "Br-Fe",
"density": 4.847839253728559,
"density_atomic": 0.04061298063726777,
"volume": 73.86800852649323,
"volume_molar": 14.82811816691408,
"formula_full": "Fe1 Br2",
"formula_reduced": "FeBr2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.8210679033333333,
"spacegroup": 164
}
]
}