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=-id&page=3644",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-id&page=3642",
"results": [
{
"id": "jvasp-117435",
"created_at": "2022-09-04T14:38:27.441964Z",
"updated_at": "2022-09-04T14:38:27.441983Z",
"structure_string": "Li4 V4 O4 F12\n1.0\n4.440173 -0.025613 -0.000049\n-0.166395 11.446259 -0.000070\n0.000068 0.000031 4.780455\nLi V O F\n4 4 4 12\ndirect\n0.010869 0.055372 0.253292 Li\n0.989128 0.944628 0.746709 Li\n0.510870 0.555373 0.246707 Li\n0.489130 0.444628 0.753289 Li\n0.030352 0.684843 0.724265 V\n0.969648 0.315156 0.275735 V\n0.469645 0.815156 0.224266 V\n0.530352 0.184843 0.775736 V\n0.740743 0.298325 0.565503 O\n0.759256 0.201675 0.065503 O\n0.240743 0.798325 0.934495 O\n0.259254 0.701675 0.434495 O\n0.747090 0.931536 0.092202 F\n0.237905 0.193529 0.428113 F\n0.252908 0.068464 0.907798 F\n0.259432 0.933128 0.413002 F\n0.240565 0.566871 0.913001 F\n0.247091 0.431536 0.407797 F\n0.262097 0.306471 0.928112 F\n0.737903 0.693529 0.071888 F\n0.759433 0.433129 0.086995 F\n0.752907 0.568464 0.592199 F\n0.740566 0.066871 0.586997 F\n0.762094 0.806472 0.571887 F\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"V",
"O",
"F"
],
"chemical_system": "F-Li-O-V",
"density": 3.5782980281456753,
"density_atomic": 0.09879045073671425,
"volume": 242.9384603574918,
"volume_molar": 6.095873351210399,
"formula_full": "Li4 V4 O4 F12",
"formula_reduced": "LiVOF3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 0.8024397579166669,
"spacegroup": 14
},
{
"id": "jvasp-117434",
"created_at": "2022-09-04T14:38:26.559963Z",
"updated_at": "2022-09-04T14:38:26.559992Z",
"structure_string": "Co1 Sn3 P4 O16\n1.0\n4.984988 0.047410 -0.000236\n-0.022200 10.009237 -0.000167\n0.000526 0.000098 6.050121\nCo Sn P O\n1 3 4 16\ndirect\n0.105540 0.723050 0.750011 Co\n0.405871 0.217066 0.749982 Sn\n0.599363 0.783235 0.250001 Sn\n0.903348 0.288306 0.249942 Sn\n0.168031 0.599685 0.250023 P\n0.383589 0.072027 0.250000 P\n0.631402 0.911938 0.749999 P\n0.815142 0.417308 0.749980 P\n0.638984 0.355850 0.555808 O\n0.859624 0.625391 0.249996 O\n0.685471 0.079608 0.250016 O\n0.782298 0.843679 0.951910 O\n0.782291 0.843678 0.548080 O\n0.691119 0.065464 0.749997 O\n0.297094 0.923899 0.250009 O\n0.094770 0.349114 0.750049 O\n0.248918 0.144911 0.045561 O\n0.332275 0.888997 0.750015 O\n0.638878 0.355884 0.944130 O\n0.308390 0.673444 0.451192 O\n0.308414 0.673422 0.048833 O\n0.226061 0.452546 0.250069 O\n0.248879 0.144928 0.454421 O\n0.844261 0.566573 0.749963 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Co",
"Sn",
"P",
"O"
],
"chemical_system": "Co-O-P-Sn",
"density": 4.3727017537683395,
"density_atomic": 0.0795010617211666,
"volume": 301.88276081362284,
"volume_molar": 7.574918660987704,
"formula_full": "Co1 Sn3 P4 O16",
"formula_reduced": "CoSn3(PO4)4",
"formula_anonymous": "AB3C4D16",
"energy_above_hull": 2.84454725,
"spacegroup": 6
},
{
"id": "jvasp-117433",
"created_at": "2022-09-04T14:38:49.880863Z",
"updated_at": "2022-09-04T14:38:49.880885Z",
"structure_string": "Li3 Fe2 Ni1 O6\n1.0\n6.295700 -0.011370 1.453403\n5.664729 2.747146 1.453403\n-0.017642 -0.004035 5.728151\nLi Fe Ni O\n3 2 1 6\ndirect\n0.500000 0.500000 0.499999 Li\n0.165086 0.165086 0.157890 Li\n0.834915 0.834914 0.842109 Li\n0.169824 0.169822 0.661794 Fe\n0.830177 0.830178 0.338205 Fe\n0.499999 0.500001 -0.000000 Ni\n0.669956 0.669955 0.889378 O\n0.328252 0.328251 0.571363 O\n0.330044 0.330045 0.110621 O\n0.986372 0.986374 0.244638 O\n0.013629 0.013626 0.755361 O\n0.671748 0.671748 0.428636 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Ni",
"O"
],
"chemical_system": "Fe-Li-Ni-O",
"density": 4.792457436362719,
"density_atomic": 0.12058734780326123,
"volume": 99.51292750528066,
"volume_molar": 4.994007140637298,
"formula_full": "Li3 Fe2 Ni1 O6",
"formula_reduced": "Li3Fe2NiO6",
"formula_anonymous": "AB2C3D6",
"energy_above_hull": 2.344200366666666,
"spacegroup": 12
},
{
"id": "jvasp-117431",
"created_at": "2022-09-04T14:38:27.429893Z",
"updated_at": "2022-09-04T14:38:27.429909Z",
"structure_string": "Mn4 F14\n1.0\n5.084632 -0.109924 1.227543\n0.086646 5.552387 1.846779\n-0.116382 -0.214393 8.425604\nMn F\n4 14\ndirect\n0.288961 0.043256 0.172857 Mn\n0.779368 0.791134 0.312105 Mn\n0.220632 0.208867 0.687893 Mn\n0.711040 0.956746 0.827142 Mn\n0.075871 0.888664 0.754261 F\n0.869358 0.257466 0.798248 F\n0.317353 0.494803 0.666138 F\n0.864847 0.732034 0.507755 F\n0.553512 0.102667 0.619145 F\n0.446488 0.897335 0.380854 F\n0.682648 0.505199 0.333861 F\n0.332524 0.096070 0.908598 F\n0.130643 0.742536 0.201751 F\n0.924129 0.111338 0.245737 F\n0.667476 0.903931 0.091401 F\n0.404727 0.325815 0.140003 F\n0.135154 0.267967 0.492244 F\n0.595274 0.674187 0.859995 F\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Mn",
"F"
],
"chemical_system": "F-Mn",
"density": 3.3501436207566875,
"density_atomic": 0.07476391971245659,
"volume": 240.75784240885616,
"volume_molar": 8.05487564477794,
"formula_full": "Mn4 F14",
"formula_reduced": "Mn2F7",
"formula_anonymous": "A2B7",
"energy_above_hull": 0.7184896066954022,
"spacegroup": 2
},
{
"id": "jvasp-117430",
"created_at": "2022-09-04T14:38:49.871318Z",
"updated_at": "2022-09-04T14:38:49.871340Z",
"structure_string": "Mn3 Fe1 P4 O16\n1.0\n5.883557 -0.000000 0.000000\n0.000000 4.790427 0.029751\n-0.000000 0.013187 9.713774\nMn Fe P O\n3 1 4 16\ndirect\n0.500000 0.913254 0.283340 Mn\n0.500000 0.582621 0.782005 Mn\n-0.000000 0.416283 0.216266 Mn\n-0.000000 0.067266 0.722161 Fe\n-0.000000 0.885634 0.404653 P\n-0.000000 0.610169 0.909590 P\n0.500000 0.392848 0.094004 P\n0.500000 0.113054 0.593458 P\n0.706929 0.260205 0.662876 O\n-0.000000 0.203025 0.377152 O\n-0.000000 0.297606 0.883562 O\n0.293605 0.242874 0.163328 O\n0.706396 0.242874 0.163328 O\n0.500000 0.347164 0.937044 O\n-0.000000 0.665713 0.065351 O\n0.500000 0.794888 0.621131 O\n0.204468 0.763064 0.836883 O\n0.500000 0.709419 0.119869 O\n0.293072 0.260205 0.662876 O\n0.793605 0.738228 0.333952 O\n0.206395 0.738228 0.333952 O\n-0.000000 0.837523 0.560174 O\n0.795533 0.763064 0.836883 O\n0.500000 0.154806 0.436153 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Mn",
"Fe",
"P",
"O"
],
"chemical_system": "Fe-Mn-O-P",
"density": 3.6424686811340097,
"density_atomic": 0.08766227083964286,
"volume": 273.77798647153753,
"volume_molar": 6.869706548004062,
"formula_full": "Mn3 Fe1 P4 O16",
"formula_reduced": "Mn3Fe(PO4)4",
"formula_anonymous": "AB3C4D16",
"energy_above_hull": 3.456034384339081,
"spacegroup": 6
},
{
"id": "jvasp-11743",
"created_at": "2022-09-04T14:37:05.798250Z",
"updated_at": "2022-09-04T14:37:05.798277Z",
"structure_string": "Li2 V4 O10\n1.0\n3.616909 0.000000 0.000000\n-1.808454 4.939126 0.000000\n0.000000 -0.000000 11.321937\nLi V O\n2 4 10\ndirect\n0.899126 0.798247 0.750000 Li\n0.100876 0.201752 0.250000 Li\n0.204160 0.408319 0.601581 V\n0.204160 0.408319 0.898419 V\n0.795843 0.591683 0.101581 V\n0.795843 0.591683 0.398419 V\n0.958138 0.916271 0.126218 O\n0.715201 0.430399 0.250000 O\n0.284801 0.569600 0.750000 O\n0.241691 0.483380 0.071284 O\n0.041865 0.083730 0.626218 O\n0.958138 0.916271 0.373783 O\n0.758312 0.516621 0.928717 O\n0.758312 0.516621 0.571284 O\n0.241691 0.483380 0.428716 O\n0.041865 0.083730 0.873782 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Li",
"V",
"O"
],
"chemical_system": "Li-O-V",
"density": 3.100423106371689,
"density_atomic": 0.07910638909265019,
"volume": 202.2592635502632,
"volume_molar": 7.612710969460139,
"formula_full": "Li2 V4 O10",
"formula_reduced": "LiV2O5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 2.8132482375,
"spacegroup": 63
},
{
"id": "jvasp-117427",
"created_at": "2022-09-04T14:38:26.535229Z",
"updated_at": "2022-09-04T14:38:26.535250Z",
"structure_string": "Li2 Mn4 B4 O12\n1.0\n5.266902 -0.008390 -2.246986\n-2.612193 8.709285 -0.184806\n-0.100421 0.037295 5.202057\nLi Mn B O\n2 4 4 12\ndirect\n0.674340 0.189478 0.254120 Li\n0.325659 0.810522 0.745880 Li\n0.744371 0.398851 0.759840 Mn\n0.751895 0.870240 0.277613 Mn\n0.248103 0.129760 0.722386 Mn\n0.255629 0.601146 0.240160 Mn\n0.744720 0.053602 0.780268 B\n0.742223 0.530531 0.274335 B\n0.257778 0.469470 0.725665 B\n0.255280 0.946398 0.219731 B\n0.281120 0.606896 0.622373 O\n0.332932 0.825571 0.141082 O\n0.358085 0.357831 0.661934 O\n0.705431 0.918280 0.887478 O\n0.294569 0.081720 0.112521 O\n0.839327 0.070510 0.566349 O\n0.667067 0.174429 0.858917 O\n0.718882 0.393104 0.377625 O\n0.862281 0.559850 0.087177 O\n0.137726 0.440154 0.912829 O\n0.641911 0.642167 0.338063 O\n0.160672 0.929490 0.433650 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Li",
"Mn",
"B",
"O"
],
"chemical_system": "B-Li-Mn-O",
"density": 3.2879282722460004,
"density_atomic": 0.09290574374298344,
"volume": 236.79913763847907,
"volume_molar": 6.481989721388795,
"formula_full": "Li2 Mn4 B4 O12",
"formula_reduced": "LiMn2(BO3)2",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 3.390406422675026,
"spacegroup": 2
},
{
"id": "jvasp-117426",
"created_at": "2022-09-04T14:38:49.892250Z",
"updated_at": "2022-09-04T14:38:49.892272Z",
"structure_string": "Na8 V2 O8\n1.0\n5.399870 -0.007795 1.908919\n1.894120 5.327422 0.956308\n0.002800 -0.044590 8.662008\nNa V O\n8 2 8\ndirect\n0.476734 0.734429 0.567337 Na\n0.947934 0.238624 0.604118 Na\n0.523266 0.265572 0.432663 Na\n0.052066 0.761377 0.395883 Na\n0.611243 0.732424 0.181818 Na\n0.758444 0.244473 0.012356 Na\n0.241556 0.755528 0.987645 Na\n0.388756 0.267576 0.818182 Na\n0.842924 0.719525 0.756317 V\n0.157076 0.280475 0.243684 V\n0.700865 0.974055 0.624352 O\n0.163025 0.523181 0.637899 O\n0.836975 0.476820 0.362102 O\n0.299135 0.025945 0.375649 O\n0.365102 0.473619 0.197551 O\n0.144686 0.152010 0.072796 O\n0.634897 0.526382 0.802450 O\n0.855314 0.847990 0.927205 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Na",
"V",
"O"
],
"chemical_system": "Na-O-V",
"density": 2.7556453192044037,
"density_atomic": 0.07218717830314443,
"volume": 249.35176056349513,
"volume_molar": 8.342396671484359,
"formula_full": "Na8 V2 O8",
"formula_reduced": "Na4VO4",
"formula_anonymous": "AB4C4",
"energy_above_hull": 1.2389493555555555,
"spacegroup": 2
},
{
"id": "jvasp-117425",
"created_at": "2022-09-04T14:38:27.394201Z",
"updated_at": "2022-09-04T14:38:27.394226Z",
"structure_string": "Mn2 Nb2 O8\n1.0\n3.945003 0.000003 0.000010\n-0.000002 3.945005 -0.000038\n-0.000019 0.000079 9.525453\nMn Nb O\n2 2 8\ndirect\n-0.000002 0.500000 0.250000 Mn\n0.500002 0.000001 0.750000 Mn\n0.000002 -0.000002 -0.000001 Nb\n0.499997 0.500001 0.500001 Nb\n0.500000 0.999999 0.959578 O\n-0.000000 0.500001 0.459592 O\n0.499998 0.000001 0.540421 O\n0.000001 0.499999 0.040408 O\n-0.000001 0.000002 0.787667 O\n0.500001 0.500000 0.287669 O\n-0.000001 -0.000000 0.212331 O\n0.500001 0.500002 0.712332 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Mn",
"Nb",
"O"
],
"chemical_system": "Mn-Nb-O",
"density": 4.745813615986157,
"density_atomic": 0.0809469913990952,
"volume": 148.24516381141416,
"volume_molar": 7.439610362179952,
"formula_full": "Mn2 Nb2 O8",
"formula_reduced": "MnNbO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.201613440229885,
"spacegroup": 119
},
{
"id": "jvasp-117422",
"created_at": "2022-09-04T14:38:49.870813Z",
"updated_at": "2022-09-04T14:38:49.870837Z",
"structure_string": "Na12 Co4 O12\n1.0\n8.917829 -0.000000 0.000000\n0.000000 8.917829 0.000000\n-0.000000 -0.000000 4.537649\nNa Co O\n12 4 12\ndirect\n0.618732 0.133402 -0.000000 Na\n0.366598 0.118732 0.500000 Na\n0.859709 0.140291 0.500000 Na\n0.359709 0.359709 -0.000000 Na\n0.866598 0.381268 -0.000000 Na\n0.118732 0.366598 0.500000 Na\n0.881268 0.633402 0.500000 Na\n0.133402 0.618732 -0.000000 Na\n0.640291 0.640291 -0.000000 Na\n0.140291 0.859709 0.500000 Na\n0.633402 0.881268 0.500000 Na\n0.381268 0.866598 -0.000000 Na\n0.884132 0.884132 -0.000000 Co\n0.384132 0.615869 0.500000 Co\n0.615869 0.384132 0.500000 Co\n0.115869 0.115869 -0.000000 Co\n0.905177 0.094823 -0.000000 O\n0.317267 0.107374 -0.000000 O\n0.607374 0.182733 0.500000 O\n0.107374 0.317267 -0.000000 O\n0.817267 0.392626 0.500000 O\n0.405177 0.405177 0.500000 O\n0.594823 0.594823 0.500000 O\n0.182733 0.607374 0.500000 O\n0.892626 0.682733 -0.000000 O\n0.392626 0.817267 0.500000 O\n0.682733 0.892626 -0.000000 O\n0.094823 0.905177 -0.000000 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Na",
"Co",
"O"
],
"chemical_system": "Co-Na-O",
"density": 3.237631998552029,
"density_atomic": 0.07759055376932365,
"volume": 360.8686707307679,
"volume_molar": 7.761435467909916,
"formula_full": "Na12 Co4 O12",
"formula_reduced": "Na3CoO3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 1.1580197714285714,
"spacegroup": 136
},
{
"id": "jvasp-117421",
"created_at": "2022-09-04T14:38:27.381073Z",
"updated_at": "2022-09-04T14:38:27.381097Z",
"structure_string": "Li3 Y1 Ni2 O6\n1.0\n5.218352 0.011899 -0.778855\n2.857840 4.368008 0.774255\n0.004848 -0.006262 5.128341\nLi Y Ni O\n3 1 2 6\ndirect\n0.195463 0.195662 0.499987 Li\n0.473606 0.473305 0.500126 Li\n0.808313 0.807892 0.500161 Li\n0.003606 0.003462 0.000139 Y\n0.336100 0.336159 -0.000036 Ni\n0.667442 0.667538 -0.000078 Ni\n0.292897 0.693041 0.765627 O\n0.087261 0.560502 0.230434 O\n0.428308 0.953727 0.230457 O\n0.953551 0.428087 0.769475 O\n0.560526 0.087240 0.769547 O\n0.692923 0.293389 0.234160 O\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Li",
"Y",
"Ni",
"O"
],
"chemical_system": "Li-Ni-O-Y",
"density": 4.5946186547668955,
"density_atomic": 0.10276103396486783,
"volume": 116.7757810232095,
"volume_molar": 5.860334922339204,
"formula_full": "Li3 Y1 Ni2 O6",
"formula_reduced": "Li3Y(NiO3)2",
"formula_anonymous": "AB2C3D6",
"energy_above_hull": 2.0230634375,
"spacegroup": 5
},
{
"id": "jvasp-117420",
"created_at": "2022-09-04T14:38:27.373078Z",
"updated_at": "2022-09-04T14:38:27.373103Z",
"structure_string": "Fe6 O10 F2\n1.0\n4.341684 -0.000000 0.000000\n0.000000 5.159528 0.345929\n-0.000000 -0.097958 7.178895\nFe O F\n6 10 2\ndirect\n0.474688 0.569119 0.162388 Fe\n0.512255 0.907902 0.835854 Fe\n0.515439 0.246815 0.488846 Fe\n0.012255 0.092098 0.164145 Fe\n0.015439 0.753185 0.511154 Fe\n0.974687 0.430881 0.837611 Fe\n0.804652 0.120814 0.932348 O\n0.809413 0.451855 0.601535 O\n0.684712 0.619139 0.938133 O\n0.698371 0.948281 0.600002 O\n0.693854 0.282632 0.262175 O\n0.193854 0.717368 0.737824 O\n0.304652 0.879186 0.067652 O\n0.184712 0.380861 0.061867 O\n0.198372 0.051719 0.399997 O\n0.309413 0.548145 0.398465 O\n0.306613 0.220803 0.733036 F\n0.806613 0.779197 0.266963 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-O",
"density": 5.499243144700079,
"density_atomic": 0.1118277476573606,
"volume": 160.9618397676386,
"volume_molar": 5.385193644829363,
"formula_full": "Fe6 O10 F2",
"formula_reduced": "Fe3O5F",
"formula_anonymous": "AB3C5",
"energy_above_hull": 2.749026031388889,
"spacegroup": 4
}
]
}