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=nsites&page=3830",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nsites&page=3828",
"results": [
{
"id": "jvasp-86936",
"created_at": "2022-09-04T14:36:19.737164Z",
"updated_at": "2022-09-04T14:36:19.737188Z",
"structure_string": "K2 La2 Ti3 O10\n1.0\n3.867973 -0.000000 -0.498613\n-0.064275 3.867439 -0.498613\n-0.013555 -0.013782 15.147000\nK La Ti O\n2 2 3 10\ndirect\n0.707970 0.707972 0.415942 K\n0.292029 0.292029 0.584059 K\n0.571784 0.571785 0.143570 La\n0.428215 0.428215 0.856430 La\n0.000000 0.000000 0.000000 Ti\n0.859048 0.859050 0.718099 Ti\n0.140951 0.140951 0.281901 Ti\n0.064704 0.064704 0.129408 O\n0.799840 0.799842 0.599683 O\n0.935295 0.935297 0.870593 O\n0.627390 0.127390 0.254780 O\n0.127389 0.627390 0.254780 O\n0.372610 0.872611 0.745220 O\n0.872610 0.372610 0.745220 O\n0.200159 0.200159 0.400318 O\n0.500000 0.000000 0.000000 O\n-0.000001 0.500000 0.000000 O\n",
"nsites": 17,
"nelements": 4,
"elements": [
"K",
"La",
"Ti",
"O"
],
"chemical_system": "K-La-O-Ti",
"density": 4.835036863551324,
"density_atomic": 0.07504422798260814,
"volume": 226.53307865249585,
"volume_molar": 8.024788743773417,
"formula_full": "K2 La2 Ti3 O10",
"formula_reduced": "K2La2Ti3O10",
"formula_anonymous": "A2B2C3D10",
"energy_above_hull": 2.5705144705882352,
"spacegroup": 139
},
{
"id": "jvasp-48396",
"created_at": "2022-09-04T14:36:14.179936Z",
"updated_at": "2022-09-04T14:36:14.179967Z",
"structure_string": "Li5 Ti1 V3 O8\n1.0\n4.074848 -0.000959 -0.000130\n-2.035734 6.156949 0.074127\n-0.000183 -1.991987 6.118572\nLi Ti V O\n5 1 3 8\ndirect\n0.941759 0.896709 0.641720 Li\n0.810490 0.634184 0.008995 Li\n0.172283 0.357839 0.004826 Li\n0.495911 0.005061 0.003768 Li\n0.047109 0.107485 0.359686 Li\n0.277858 0.568841 0.678264 Ti\n0.710746 0.434833 0.338801 V\n0.611806 0.236883 0.674129 V\n0.379121 0.771431 0.325827 V\n0.651604 0.316472 0.005523 O\n0.880205 0.773605 0.324655 O\n0.440567 0.894343 0.664277 O\n0.784203 0.581548 0.682849 O\n0.333421 0.680039 0.997850 O\n0.209230 0.431791 0.333336 O\n0.545302 0.103860 0.336657 O\n0.108557 0.230378 0.679281 O\n",
"nsites": 17,
"nelements": 4,
"elements": [
"Li",
"Ti",
"V",
"O"
],
"chemical_system": "Li-O-Ti-V",
"density": 3.9159149592349736,
"density_atomic": 0.110320970084481,
"volume": 154.09581684227243,
"volume_molar": 5.45874529147849,
"formula_full": "Li5 Ti1 V3 O8",
"formula_reduced": "Li5TiV3O8",
"formula_anonymous": "AB3C5D8",
"energy_above_hull": 2.7806675843137256,
"spacegroup": 8
},
{
"id": "jvasp-11369",
"created_at": "2022-09-04T14:36:39.836010Z",
"updated_at": "2022-09-04T14:36:39.836027Z",
"structure_string": "Nd1 Fe4 Sb12\n1.0\n7.513908 -0.000000 -2.656568\n-3.756954 6.507236 -2.656568\n0.000000 0.000000 7.969704\nNd Fe Sb\n1 4 12\ndirect\n0.000000 0.000000 0.000000 Nd\n-0.000000 -0.000000 0.500000 Fe\n0.500001 0.500000 0.500000 Fe\n0.500000 0.000000 -0.000000 Fe\n0.000000 0.500000 0.000000 Fe\n0.503929 0.837731 0.666197 Sb\n0.496072 0.162270 0.333802 Sb\n0.162270 0.666198 0.828467 Sb\n0.333803 0.171533 0.837730 Sb\n0.171534 0.837731 0.333802 Sb\n0.666198 0.828468 0.162269 Sb\n0.837731 0.333803 0.171533 Sb\n0.666198 0.503928 0.837730 Sb\n0.333803 0.496072 0.162269 Sb\n0.162270 0.333803 0.496072 Sb\n0.828467 0.162270 0.666197 Sb\n0.837731 0.666198 0.503928 Sb\n",
"nsites": 17,
"nelements": 3,
"elements": [
"Nd",
"Fe",
"Sb"
],
"chemical_system": "Fe-Nd-Sb",
"density": 7.792860715895989,
"density_atomic": 0.04362588986839612,
"volume": 389.6768650744544,
"volume_molar": 13.804052543493484,
"formula_full": "Nd1 Fe4 Sb12",
"formula_reduced": "Nd(FeSb3)4",
"formula_anonymous": "AB4C12",
"energy_above_hull": 2.546306276470588,
"spacegroup": 204
},
{
"id": "jvasp-95309",
"created_at": "2022-09-04T14:36:18.487505Z",
"updated_at": "2022-09-04T14:36:18.487540Z",
"structure_string": "Li2 Ca2 Ta3 O10\n1.0\n3.937092 0.000000 -0.570279\n-0.082603 3.936225 -0.570279\n-0.067081 -0.068503 13.412470\nLi Ca Ta O\n2 2 3 10\ndirect\n0.750000 0.250000 0.500000 Li\n0.250001 0.749999 0.500000 Li\n0.584853 0.584852 0.169704 Ca\n0.415148 0.415148 0.830295 Ca\n0.844167 0.844166 0.688332 Ta\n0.000000 0.000000 0.000000 Ta\n0.155833 0.155833 0.311668 Ta\n0.500000 -0.000000 -0.000000 O\n0.000000 0.499999 -0.000000 O\n0.075465 0.075465 0.150931 O\n0.645339 0.145339 0.290680 O\n0.145340 0.645339 0.290680 O\n0.228142 0.228142 0.456283 O\n0.771859 0.771858 0.543717 O\n0.854661 0.354661 0.709320 O\n0.354661 0.854660 0.709320 O\n0.924536 0.924535 0.849069 O\n",
"nsites": 17,
"nelements": 4,
"elements": [
"Li",
"Ca",
"Ta",
"O"
],
"chemical_system": "Ca-Li-O-Ta",
"density": 6.375563939941951,
"density_atomic": 0.08190829364888629,
"volume": 207.54918998646664,
"volume_molar": 7.35229668660285,
"formula_full": "Li2 Ca2 Ta3 O10",
"formula_reduced": "Li2Ca2Ta3O10",
"formula_anonymous": "A2B2C3D10",
"energy_above_hull": 3.1211896141176467,
"spacegroup": 139
},
{
"id": "jvasp-42576",
"created_at": "2022-09-04T14:36:19.629703Z",
"updated_at": "2022-09-04T14:36:19.629727Z",
"structure_string": "Li5 Fe4 O8\n1.0\n5.806513 0.046803 0.033175\n2.915928 5.021468 0.033175\n2.915928 1.694332 4.727101\nLi Fe O\n5 4 8\ndirect\n0.964777 0.553519 0.964778 Li\n0.964777 0.964776 0.553523 Li\n0.128180 0.128180 0.128180 Li\n0.553521 0.964776 0.964778 Li\n0.487206 0.487205 0.487207 Li\n0.491018 0.986577 0.491020 Fe\n0.491018 0.491017 0.986579 Fe\n0.981117 0.981116 0.981119 Fe\n0.986578 0.491017 0.491020 Fe\n0.745111 0.745111 0.250151 O\n0.251990 0.251989 0.251990 O\n0.227053 0.227052 0.737250 O\n0.227053 0.737249 0.227054 O\n0.737249 0.227052 0.227054 O\n0.250150 0.745111 0.745112 O\n0.745111 0.250149 0.745112 O\n0.731781 0.731780 0.731783 O\n",
"nsites": 17,
"nelements": 3,
"elements": [
"Li",
"Fe",
"O"
],
"chemical_system": "Fe-Li-O",
"density": 4.695326735184451,
"density_atomic": 0.12450537864804787,
"volume": 136.54028592656744,
"volume_molar": 4.836851889767271,
"formula_full": "Li5 Fe4 O8",
"formula_reduced": "Li5(FeO2)4",
"formula_anonymous": "A4B5C8",
"energy_above_hull": 2.593420588235294,
"spacegroup": 160
},
{
"id": "jvasp-86927",
"created_at": "2022-09-04T14:36:18.647560Z",
"updated_at": "2022-09-04T14:36:18.647591Z",
"structure_string": "Na2 La2 Ti3 O10\n1.0\n3.828379 -0.000000 -0.510018\n-0.067945 3.827776 -0.510018\n0.000341 0.000347 14.626147\nNa La Ti O\n2 2 3 10\ndirect\n0.288724 0.288725 0.577448 Na\n0.711277 0.711277 0.422552 Na\n0.424854 0.424854 0.849707 La\n0.575148 0.575147 0.150293 La\n0.000000 0.000000 0.000000 Ti\n0.148220 0.148220 0.296439 Ti\n0.851781 0.851781 0.703561 Ti\n0.500000 0.000000 -0.000000 O\n0.866486 0.366487 0.732973 O\n0.000001 0.500000 -0.000000 O\n0.209314 0.209314 0.418628 O\n0.790688 0.790688 0.581372 O\n0.633515 0.133515 0.267027 O\n0.133515 0.633515 0.267028 O\n0.366487 0.866487 0.732973 O\n0.067506 0.067506 0.135011 O\n0.932496 0.932496 0.864989 O\n",
"nsites": 17,
"nelements": 4,
"elements": [
"Na",
"La",
"Ti",
"O"
],
"chemical_system": "La-Na-O-Ti",
"density": 4.860595038936633,
"density_atomic": 0.07931490362914959,
"volume": 214.33550596602137,
"volume_molar": 7.592697569371768,
"formula_full": "Na2 La2 Ti3 O10",
"formula_reduced": "Na2La2Ti3O10",
"formula_anonymous": "A2B2C3D10",
"energy_above_hull": 2.604974,
"spacegroup": 139
},
{
"id": "jvasp-121327",
"created_at": "2022-09-04T14:38:50.169918Z",
"updated_at": "2022-09-04T14:38:50.169937Z",
"structure_string": "Tb6 Os1 I10\n1.0\n7.600475 -0.019542 -0.951160\n-2.890193 8.669919 -2.918027\n-0.021895 -0.023599 9.652383\nTb Os I\n6 1 10\ndirect\n0.359479 0.131387 0.170786 Tb\n0.640522 0.868613 0.829214 Tb\n0.973950 0.286400 0.086221 Tb\n0.026050 0.713600 0.913778 Tb\n0.887047 0.962019 0.245638 Tb\n0.112953 0.037981 0.754362 Tb\n0.000000 0.000000 0.000000 Os\n0.272493 0.090339 0.466122 I\n0.727507 0.909661 0.533878 I\n0.450776 0.811981 0.092991 I\n0.549224 0.188019 0.907009 I\n0.633621 0.535063 0.722511 I\n0.797309 0.270843 0.359925 I\n0.910754 0.628940 0.184233 I\n0.366379 0.464937 0.277489 I\n0.202692 0.729157 0.640075 I\n0.089246 0.371061 0.815767 I\n",
"nsites": 17,
"nelements": 3,
"elements": [
"Tb",
"Os",
"I"
],
"chemical_system": "I-Os-Tb",
"density": 6.312245744537367,
"density_atomic": 0.026782898414990958,
"volume": 634.7333935480538,
"volume_molar": 22.48502259422856,
"formula_full": "Tb6 Os1 I10",
"formula_reduced": "Tb6OsI10",
"formula_anonymous": "AB6C10",
"energy_above_hull": 0.7615498911764705,
"spacegroup": 2
},
{
"id": "jvasp-119300",
"created_at": "2022-09-04T14:38:50.409397Z",
"updated_at": "2022-09-04T14:38:50.409427Z",
"structure_string": "Ni1 N2 F14\n1.0\n5.757202 0.046412 -3.233788\n-1.950707 5.416850 -3.233788\n-0.032337 -0.046412 6.603159\nNi N F\n1 2 14\ndirect\n0.000000 0.000000 0.000000 Ni\n0.749999 0.250000 0.499999 N\n0.249999 0.750000 0.500000 N\n0.252781 0.688178 0.274493 F\n0.586316 0.021712 0.274493 F\n0.021712 0.747219 0.435396 F\n0.311822 0.586316 0.564603 F\n0.747218 0.311822 0.725506 F\n0.805314 0.805314 -0.000001 F\n0.194686 0.194686 -0.000000 F\n0.761640 0.866028 0.627669 F\n0.866028 0.238359 0.104387 F\n0.133971 0.761641 0.895612 F\n0.238359 0.133972 0.372330 F\n0.413683 0.978288 0.725506 F\n0.688177 0.413684 0.435396 F\n0.978287 0.252781 0.564603 F\n",
"nsites": 17,
"nelements": 3,
"elements": [
"Ni",
"N",
"F"
],
"chemical_system": "F-N-Ni",
"density": 2.8595335831789215,
"density_atomic": 0.08300585356029529,
"volume": 204.80483328385068,
"volume_molar": 7.255079613904012,
"formula_full": "Ni1 N2 F14",
"formula_reduced": "Ni(NF7)2",
"formula_anonymous": "AB2C14",
"energy_above_hull": 0.6419784032352941,
"spacegroup": 87
},
{
"id": "jvasp-119608",
"created_at": "2022-09-04T14:38:50.149408Z",
"updated_at": "2022-09-04T14:38:50.149438Z",
"structure_string": "Pr1 P12 Os4\n1.0\n6.672675 0.000000 -2.359147\n-3.336337 5.778706 -2.359147\n0.000000 0.000000 7.077441\nPr P Os\n1 12 4\ndirect\n0.000000 0.000000 0.000000 Pr\n0.143190 0.356444 0.499635 P\n0.856809 0.643556 0.500364 P\n0.143190 0.643556 0.786746 P\n0.856809 0.356444 0.213253 P\n0.500365 0.856810 0.643555 P\n0.499634 0.143191 0.356444 P\n0.213253 0.856810 0.356444 P\n0.356444 0.499635 0.143190 P\n0.643555 0.500366 0.856809 P\n0.643555 0.786747 0.143190 P\n0.356444 0.213254 0.856809 P\n0.786746 0.143191 0.643555 P\n-0.000000 0.500000 -0.000000 Os\n-0.000000 -0.000000 0.500000 Os\n0.500000 -0.000000 -0.000000 Os\n0.500000 0.500000 0.500000 Os\n",
"nsites": 17,
"nelements": 3,
"elements": [
"Pr",
"P",
"Os"
],
"chemical_system": "Os-P-Pr",
"density": 7.748998555586485,
"density_atomic": 0.062293408034453324,
"volume": 272.9020700006912,
"volume_molar": 9.667380466114915,
"formula_full": "Pr1 P12 Os4",
"formula_reduced": "Pr(P3Os)4",
"formula_anonymous": "AB4C12",
"energy_above_hull": 4.480687402941177,
"spacegroup": 204
},
{
"id": "jvasp-45239",
"created_at": "2022-09-04T14:38:05.340933Z",
"updated_at": "2022-09-04T14:38:05.340959Z",
"structure_string": "Li5 V4 O8\n1.0\n5.934334 0.018051 0.010923\n2.950549 5.157950 0.007947\n2.953995 1.735802 4.856223\nLi V O\n5 4 8\ndirect\n0.979155 0.980786 0.061065 Li\n0.980849 0.979204 0.478927 Li\n0.561056 0.978965 0.479179 Li\n0.125002 0.125009 0.625005 Li\n0.978935 0.561069 0.480854 Li\n0.500048 0.000506 -0.000548 V\n0.499454 0.499974 0.000051 V\n0.000513 0.500043 -0.000022 V\n0.499980 0.499459 0.500508 V\n0.253944 0.739899 0.752399 O\n0.746151 0.746832 0.760958 O\n0.746060 0.260959 0.246826 O\n0.746824 0.746139 0.246056 O\n0.260959 0.746055 0.246148 O\n0.252398 0.253767 0.753933 O\n0.739896 0.253947 0.753766 O\n0.253766 0.252382 0.239897 O\n",
"nsites": 17,
"nelements": 3,
"elements": [
"Li",
"V",
"O"
],
"chemical_system": "Li-O-V",
"density": 4.106328706561537,
"density_atomic": 0.114714841714433,
"volume": 148.19355321362156,
"volume_molar": 5.249661395158703,
"formula_full": "Li5 V4 O8",
"formula_reduced": "Li5V4O8",
"formula_anonymous": "A4B5C8",
"energy_above_hull": 2.8277826352941173,
"spacegroup": 216
},
{
"id": "jvasp-45896",
"created_at": "2022-09-04T14:38:04.862186Z",
"updated_at": "2022-09-04T14:38:04.862211Z",
"structure_string": "Li6 Fe1 Si2 O8\n1.0\n5.080147 0.023852 0.001581\n0.412677 5.446395 -0.060727\n1.158475 0.057122 6.059381\nLi Fe Si O\n6 1 2 8\ndirect\n0.847141 0.600868 0.190649 Li\n0.383923 0.737232 0.967435 Li\n0.229292 0.631413 0.391611 Li\n0.770710 0.368586 0.608389 Li\n0.616079 0.262766 0.032564 Li\n0.152862 0.399130 0.809351 Li\n0.500001 -0.000000 0.500000 Fe\n0.119802 0.197085 0.275057 Si\n0.880200 0.802913 0.724942 Si\n0.706116 0.067914 0.776699 O\n0.211000 0.785647 0.706616 O\n0.293886 0.932084 0.223300 O\n0.814572 0.711933 0.484288 O\n0.765945 0.588286 0.901921 O\n0.234058 0.411712 0.098078 O\n0.185430 0.288066 0.515711 O\n0.789003 0.214352 0.293383 O\n",
"nsites": 17,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Si",
"O"
],
"chemical_system": "Fe-Li-O-Si",
"density": 2.7905849341371316,
"density_atomic": 0.1014318184632183,
"volume": 167.60026841246687,
"volume_molar": 5.937131810550925,
"formula_full": "Li6 Fe1 Si2 O8",
"formula_reduced": "Li6Fe(SiO4)2",
"formula_anonymous": "AB2C6D8",
"energy_above_hull": 2.3045812176470584,
"spacegroup": 2
},
{
"id": "jvasp-45792",
"created_at": "2022-09-04T14:38:04.764485Z",
"updated_at": "2022-09-04T14:38:04.764503Z",
"structure_string": "Nb4 V1 O12\n1.0\n5.116042 -0.012598 0.010876\n0.022246 5.609867 0.023003\n0.042136 0.742376 7.695748\nNb V O\n4 1 12\ndirect\n0.972391 0.993630 0.018835 Nb\n0.511679 0.531480 0.489877 Nb\n0.008101 0.999943 0.498456 Nb\n0.481695 0.507943 0.022054 Nb\n0.016306 0.395678 0.721330 V\n0.297838 0.228062 0.069343 O\n0.202981 0.337910 0.481169 O\n0.811061 0.363640 0.923197 O\n0.325563 0.529623 0.758523 O\n0.622467 0.525527 0.258575 O\n0.839374 0.698609 0.597256 O\n0.102467 0.067372 0.768193 O\n0.675256 0.842156 0.953169 O\n0.877684 0.032850 0.271065 O\n0.735646 0.255451 0.581312 O\n0.183537 0.720839 0.066061 O\n0.335966 0.850697 0.462291 O\n",
"nsites": 17,
"nelements": 3,
"elements": [
"Nb",
"V",
"O"
],
"chemical_system": "Nb-O-V",
"density": 4.62219285152785,
"density_atomic": 0.0769987585071148,
"volume": 220.7827805227428,
"volume_molar": 7.821088127600843,
"formula_full": "Nb4 V1 O12",
"formula_reduced": "Nb4VO12",
"formula_anonymous": "AB4C12",
"energy_above_hull": 3.917779047058824,
"spacegroup": 1
}
]
}