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=density&page=1259",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density&page=1257",
"results": [
{
"id": "jvasp-42994",
"created_at": "2022-09-04T14:38:09.749510Z",
"updated_at": "2022-09-04T14:38:09.749540Z",
"structure_string": "Li2 V2 Cr2 O8\n1.0\n5.773213 0.000000 0.000000\n2.886607 5.076439 -0.027905\n2.886607 1.665837 4.795414\nLi V Cr O\n2 2 2 8\ndirect\n0.125101 0.124899 0.124898 Li\n0.874899 0.875103 0.875100 Li\n0.000001 0.500001 0.499999 V\n0.500000 0.500001 0.499999 V\n0.500000 0.000000 0.500000 Cr\n0.500000 0.500000 -0.000001 Cr\n0.257322 0.264534 0.264533 O\n0.259304 0.264291 0.717103 O\n0.259304 0.717104 0.264289 O\n0.713612 0.264534 0.264533 O\n0.286389 0.735467 0.735465 O\n0.740697 0.735711 0.282895 O\n0.740697 0.282897 0.735709 O\n0.742679 0.735467 0.735465 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"V",
"Cr",
"O"
],
"chemical_system": "Cr-Li-O-V",
"density": 4.100981979301887,
"density_atomic": 0.09942524347483904,
"volume": 140.80931070128983,
"volume_molar": 6.056953495441012,
"formula_full": "Li2 V2 Cr2 O8",
"formula_reduced": "LiVCrO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.837129371428573,
"spacegroup": 74
},
{
"id": "jvasp-9626",
"created_at": "2022-09-04T14:37:12.365538Z",
"updated_at": "2022-09-04T14:37:12.365568Z",
"structure_string": "Ca4 V4 O10\n1.0\n0.000000 5.281340 -0.000037\n3.897691 0.000000 0.000000\n0.000000 -0.000130 -10.307977\nCa V O\n4 4 10\ndirect\n0.786218 0.500000 0.124545 Ca\n0.213781 0.500000 0.875454 Ca\n0.286219 0.500000 0.375455 Ca\n0.713778 0.500000 0.624546 Ca\n0.775956 0.000000 0.375024 V\n0.224044 0.000000 0.624978 V\n0.724042 0.000000 0.875023 V\n0.275959 0.000000 0.124976 V\n0.790586 0.500000 0.388208 O\n0.105037 0.000000 0.289818 O\n0.290585 0.500000 0.111793 O\n0.709417 0.500000 0.888207 O\n0.499999 0.000000 0.499999 O\n0.394965 0.000000 0.789817 O\n0.894963 0.000000 0.710183 O\n0.000000 0.000000 0.000001 O\n0.605036 0.000000 0.210183 O\n0.209416 0.500000 0.611794 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ca",
"V",
"O"
],
"chemical_system": "Ca-O-V",
"density": 4.10123901365664,
"density_atomic": 0.08482962178960574,
"volume": 212.1900300892955,
"volume_molar": 7.0991012725909615,
"formula_full": "Ca4 V4 O10",
"formula_reduced": "Ca2V2O5",
"formula_anonymous": "A2B2C5",
"energy_above_hull": 2.3066563044444446,
"spacegroup": 55
},
{
"id": "jvasp-38033",
"created_at": "2022-09-04T14:38:01.692659Z",
"updated_at": "2022-09-04T14:38:01.692676Z",
"structure_string": "Ge2 Cl2 F2\n1.0\n3.740865 -0.000000 -0.000000\n0.000000 3.740865 -0.000000\n0.000000 0.000000 7.353852\nGe Cl F\n2 2 2\ndirect\n0.500001 0.000000 0.806985 Ge\n0.000000 0.500001 0.193015 Ge\n0.000000 0.500001 0.657130 Cl\n0.500001 0.000000 0.342870 Cl\n0.000000 0.000000 0.000000 F\n0.500001 0.500001 0.000000 F\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ge",
"Cl",
"F"
],
"chemical_system": "Cl-F-Ge",
"density": 4.1014395144201234,
"density_atomic": 0.05830318682719439,
"volume": 102.91032663074631,
"volume_molar": 10.329007877132181,
"formula_full": "Ge2 Cl2 F2",
"formula_reduced": "GeClF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 129
},
{
"id": "jvasp-118393",
"created_at": "2022-09-04T14:38:39.398413Z",
"updated_at": "2022-09-04T14:38:39.398445Z",
"structure_string": "Ge1 P1\n1.0\n4.344635 0.000000 0.000000\n-2.172317 3.762564 -0.000000\n0.000000 0.000000 2.566167\nGe P\n1 1\ndirect\n0.000000 0.000000 0.000000 Ge\n0.333332 0.666666 0.000000 P\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ge",
"P"
],
"chemical_system": "Ge-P",
"density": 4.101516203213645,
"density_atomic": 0.04767688661610239,
"volume": 41.94904789199301,
"volume_molar": 12.631153557678159,
"formula_full": "Ge1 P1",
"formula_reduced": "GeP",
"formula_anonymous": "AB",
"energy_above_hull": 1.3466657249999998,
"spacegroup": 187
},
{
"id": "jvasp-48342",
"created_at": "2022-09-04T14:36:17.861564Z",
"updated_at": "2022-09-04T14:36:17.861592Z",
"structure_string": "Mn6 O2 F10\n1.0\n4.796279 -0.083475 0.008810\n-0.083475 4.796279 0.008810\n0.018835 0.018835 9.710743\nMn O F\n6 2 10\ndirect\n0.964012 0.964012 0.003356 Mn\n0.035990 0.035990 0.329977 Mn\n0.000001 0.000001 0.666667 Mn\n0.503516 0.503516 0.844900 Mn\n0.500001 0.500001 0.166667 Mn\n0.496486 0.496486 0.488434 Mn\n0.325987 0.325987 0.324759 O\n0.674015 0.674015 0.008574 O\n0.796769 0.203233 0.166667 F\n0.690558 0.690558 0.658819 F\n0.726247 0.726247 0.330896 F\n0.309444 0.309444 0.674513 F\n0.203233 0.796769 0.166667 F\n0.182115 0.787392 0.833844 F\n0.212610 0.817887 0.499490 F\n0.817887 0.212610 0.499490 F\n0.273755 0.273755 0.002437 F\n0.787392 0.182115 0.833844 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Mn",
"O",
"F"
],
"chemical_system": "F-Mn-O",
"density": 4.101620525526656,
"density_atomic": 0.08060201276234068,
"volume": 223.31948524752053,
"volume_molar": 7.471452081173957,
"formula_full": "Mn6 O2 F10",
"formula_reduced": "Mn3OF5",
"formula_anonymous": "AB3C5",
"energy_above_hull": 1.634642959626437,
"spacegroup": 12
},
{
"id": "jvasp-50953",
"created_at": "2022-09-04T14:36:44.325549Z",
"updated_at": "2022-09-04T14:36:44.325565Z",
"structure_string": "Ba2 Sr1 I6\n1.0\n8.579717 -0.000000 0.000421\n-4.289858 7.429681 -0.000211\n0.000050 0.000000 7.136588\nBa Sr I\n2 1 6\ndirect\n0.333321 0.666664 0.499997 Ba\n0.666657 0.333336 0.499997 Ba\n0.999989 0.000000 0.999991 Sr\n-0.000005 0.670823 0.763592 I\n-0.000017 0.329166 0.236413 I\n0.329172 0.329177 0.763592 I\n0.670817 0.670834 0.236413 I\n0.329135 0.000000 0.236485 I\n0.670834 0.000000 0.763519 I\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ba",
"Sr",
"I"
],
"chemical_system": "Ba-I-Sr",
"density": 4.101720277303512,
"density_atomic": 0.019783756310637696,
"volume": 454.9186645187655,
"volume_molar": 30.439824800924708,
"formula_full": "Ba2 Sr1 I6",
"formula_reduced": "Ba2SrI6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 0.0105755555555555,
"spacegroup": 162
},
{
"id": "jvasp-91456",
"created_at": "2022-09-04T14:36:21.864510Z",
"updated_at": "2022-09-04T14:36:21.864536Z",
"structure_string": "Na8 In4 Ni4 F28\n1.0\n7.352835 0.000000 0.000000\n0.000000 7.516630 0.000000\n0.000000 0.000000 10.327500\nNa In Ni F\n8 4 4 28\ndirect\n0.000000 0.500000 0.000000 Na\n0.500000 0.500000 0.000000 Na\n0.000000 0.000000 0.500000 Na\n0.500000 0.000000 0.500000 Na\n0.250000 0.249870 0.771154 Na\n0.250000 0.250130 0.271154 Na\n0.750000 0.749870 0.728846 Na\n0.750000 0.750130 0.228846 Na\n0.250000 0.777085 0.767992 In\n0.750000 0.222915 0.232008 In\n0.750000 0.277085 0.732008 In\n0.250000 0.722915 0.267992 In\n0.000000 0.000000 0.000000 Ni\n0.000000 0.500000 0.500000 Ni\n0.500000 0.500000 0.500000 Ni\n0.500000 0.000000 0.000000 Ni\n0.449646 0.802393 0.125926 F\n0.750000 0.472935 0.140166 F\n0.250000 0.527065 0.859834 F\n0.250000 0.497631 0.150801 F\n0.750000 0.502369 0.849199 F\n0.750000 -0.002369 0.349199 F\n0.250000 0.002369 0.650801 F\n0.250000 0.487178 0.425898 F\n0.750000 0.512822 0.574101 F\n0.750000 0.987178 0.074101 F\n0.250000 0.012822 0.925898 F\n0.949647 0.197607 0.874074 F\n0.050354 0.697607 0.625926 F\n0.010737 0.305445 0.632963 F\n0.050354 0.802393 0.125926 F\n0.550354 0.197607 0.874074 F\n0.949647 0.302393 0.374074 F\n0.449646 0.697607 0.625926 F\n0.989264 0.805445 0.867037 F\n0.489263 0.194555 0.132963 F\n0.750000 0.027065 0.640166 F\n0.510737 0.694555 0.367037 F\n0.010737 0.194555 0.132963 F\n0.510737 0.805445 0.867037 F\n0.989264 0.694555 0.367037 F\n0.489263 0.305445 0.632963 F\n0.550354 0.302393 0.374074 F\n0.250000 0.972935 0.359834 F\n",
"nsites": 44,
"nelements": 4,
"elements": [
"Na",
"In",
"Ni",
"F"
],
"chemical_system": "F-In-Na-Ni",
"density": 4.101758408645495,
"density_atomic": 0.07708670445588449,
"volume": 570.7858483583315,
"volume_molar": 7.812165278704288,
"formula_full": "Na8 In4 Ni4 F28",
"formula_reduced": "Na2InNiF7",
"formula_anonymous": "ABC2D7",
"energy_above_hull": 0.0,
"spacegroup": 62
},
{
"id": "jvasp-15342",
"created_at": "2022-09-04T14:36:59.143658Z",
"updated_at": "2022-09-04T14:36:59.143687Z",
"structure_string": "K2 Mn2 Sb2\n1.0\n4.634861 0.000000 0.000000\n0.000000 4.634861 0.000000\n0.000000 0.000000 8.133209\nK Mn Sb\n2 2 2\ndirect\n0.000000 0.500000 0.650983 K\n0.500000 0.000000 0.349017 K\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.000000 Mn\n0.000000 0.500000 0.189797 Sb\n0.500000 0.000000 0.810203 Sb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"K",
"Mn",
"Sb"
],
"chemical_system": "K-Mn-Sb",
"density": 4.101925958909142,
"density_atomic": 0.034341233425689545,
"volume": 174.71707919237397,
"volume_molar": 17.536180734542388,
"formula_full": "K2 Mn2 Sb2",
"formula_reduced": "KMnSb",
"formula_anonymous": "ABC",
"energy_above_hull": 1.414517113793104,
"spacegroup": 129
},
{
"id": "jvasp-13407",
"created_at": "2022-09-04T14:37:10.871190Z",
"updated_at": "2022-09-04T14:37:10.871209Z",
"structure_string": "Rb12 Cu4 O8\n1.0\n0.000000 6.727923 -0.010633\n9.711117 0.000000 0.000000\n0.000000 -3.524336 -8.717089\nRb Cu O\n12 4 8\ndirect\n0.238575 0.709622 0.312260 Rb\n0.245415 0.463997 0.005125 Rb\n0.245415 0.036004 0.505125 Rb\n0.754584 0.536004 0.994875 Rb\n0.734656 0.522363 0.375120 Rb\n0.265343 0.022363 0.124879 Rb\n0.754584 0.963997 0.494875 Rb\n0.734656 0.977637 0.875120 Rb\n0.238575 0.790378 0.812260 Rb\n0.761423 0.290378 0.687740 Rb\n0.761424 0.209622 0.187740 Rb\n0.265342 0.477637 0.624879 Rb\n0.292253 0.320420 0.327241 Cu\n0.707746 0.820420 0.172758 Cu\n0.707745 0.679580 0.672759 Cu\n0.292253 0.179580 0.827241 Cu\n0.512428 0.302015 0.879334 O\n0.067745 0.060550 0.777963 O\n0.932253 0.560551 0.722037 O\n0.932254 0.939450 0.222037 O\n0.067745 0.439450 0.277963 O\n0.487571 0.697985 0.120666 O\n0.512428 0.197985 0.379334 O\n0.487571 0.802016 0.620666 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Rb",
"Cu",
"O"
],
"chemical_system": "Cu-O-Rb",
"density": 4.101934729475781,
"density_atomic": 0.04211260919266922,
"volume": 569.900570401556,
"volume_molar": 14.300089392343585,
"formula_full": "Rb12 Cu4 O8",
"formula_reduced": "Rb3CuO2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.1228072500000001,
"spacegroup": 14
},
{
"id": "jvasp-42722",
"created_at": "2022-09-04T14:35:55.712686Z",
"updated_at": "2022-09-04T14:35:55.712709Z",
"structure_string": "Li2 Co2 O2 F4\n1.0\n4.918844 0.024415 0.044161\n-2.200487 4.399042 -0.044247\n-2.135071 -1.734655 4.464433\nLi Co O F\n2 2 2 4\ndirect\n0.878501 0.419988 0.345677 Li\n0.926827 0.968328 0.845666 Li\n0.476427 0.740100 0.217998 Co\n0.479024 0.242683 0.718003 Co\n0.389258 0.375922 0.991705 O\n0.616955 0.103591 0.491736 O\n0.659379 0.015064 0.003702 F\n0.979036 0.639929 0.972252 F\n0.333432 0.494309 0.472232 F\n0.989773 0.845444 0.503702 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Li",
"Co",
"O",
"F"
],
"chemical_system": "Co-F-Li-O",
"density": 4.101987717197027,
"density_atomic": 0.10303939566722897,
"volume": 97.05025864374743,
"volume_molar": 5.844503183470537,
"formula_full": "Li2 Co2 O2 F4",
"formula_reduced": "LiCoOF2",
"formula_anonymous": "ABCD2",
"energy_above_hull": 0.8957309930000003,
"spacegroup": 9
},
{
"id": "jvasp-58891",
"created_at": "2022-09-04T14:37:16.720972Z",
"updated_at": "2022-09-04T14:37:16.721003Z",
"structure_string": "Rb12 Cu4 O8\n1.0\n0.000000 6.727831 -0.010800\n9.711600 0.000000 0.000000\n0.000000 -3.524069 -8.716427\nRb Cu O\n12 4 8\ndirect\n0.238618 0.709614 0.312267 Rb\n0.245415 0.464029 0.005133 Rb\n0.245415 0.035971 0.505133 Rb\n0.754585 0.535971 0.994868 Rb\n0.734687 0.522380 0.375108 Rb\n0.265313 0.022380 0.124892 Rb\n0.754585 0.964029 0.494868 Rb\n0.734687 0.977620 0.875108 Rb\n0.238618 0.790386 0.812267 Rb\n0.761382 0.290386 0.687734 Rb\n0.761382 0.209614 0.187733 Rb\n0.265313 0.477620 0.624893 Rb\n0.292227 0.320437 0.327222 Cu\n0.707773 0.820437 0.172778 Cu\n0.707773 0.679563 0.672778 Cu\n0.292227 0.179563 0.827222 Cu\n0.512379 0.302008 0.879330 O\n0.067710 0.060537 0.777940 O\n0.932290 0.560537 0.722061 O\n0.932290 0.939463 0.222061 O\n0.067710 0.439463 0.277940 O\n0.487621 0.697992 0.120670 O\n0.512379 0.197992 0.379330 O\n0.487621 0.802008 0.620670 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Rb",
"Cu",
"O"
],
"chemical_system": "Cu-O-Rb",
"density": 4.10205715952172,
"density_atomic": 0.04211386612360988,
"volume": 569.8835611424694,
"volume_molar": 14.299662591708406,
"formula_full": "Rb12 Cu4 O8",
"formula_reduced": "Rb3CuO2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.1228205833333334,
"spacegroup": 14
},
{
"id": "jvasp-85370",
"created_at": "2022-09-04T14:35:52.524785Z",
"updated_at": "2022-09-04T14:35:52.524821Z",
"structure_string": "Al1 P1 O4\n1.0\n2.716932 0.000000 0.000000\n0.000000 4.267347 0.046188\n0.000000 0.248739 4.260585\nAl P O\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500001 P\n0.500000 0.212374 0.787696 O\n0.000000 0.681931 0.681857 O\n0.500000 0.787626 0.212306 O\n0.000000 0.318070 0.318144 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Al",
"P",
"O"
],
"chemical_system": "Al-O-P",
"density": 4.102133458862561,
"density_atomic": 0.12154016014005191,
"volume": 49.36639867090961,
"volume_molar": 4.954856693508243,
"formula_full": "Al1 P1 O4",
"formula_reduced": "AlPO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.227758716666667,
"spacegroup": 65
}
]
}