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=892",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nsites&page=890",
"results": [
{
"id": "jvasp-9784",
"created_at": "2022-09-04T14:37:12.190794Z",
"updated_at": "2022-09-04T14:37:12.190811Z",
"structure_string": "Cd4 Ga2 Ag2 S8\n1.0\n6.679733 0.000000 0.000000\n0.000000 6.961780 0.000000\n0.000000 0.000000 8.189083\nCd Ga Ag S\n4 2 2 8\ndirect\n0.486435 0.175441 0.252610 Cd\n0.986434 0.824559 0.752609 Cd\n0.486435 0.175441 0.747390 Cd\n0.986434 0.824559 0.247390 Cd\n0.491122 0.676937 0.500000 Ga\n0.991122 0.323063 0.000000 Ga\n0.989857 0.341004 0.500000 Ag\n0.489858 0.658996 0.000000 Ag\n0.107936 0.634532 0.000000 S\n0.607936 0.365468 0.500000 S\n0.146462 0.677704 0.500000 S\n0.646461 0.322296 0.000000 S\n0.603756 0.824708 0.265588 S\n0.103757 0.175292 0.765588 S\n0.103757 0.175292 0.234411 S\n0.603756 0.824708 0.734411 S\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Cd",
"Ga",
"Ag",
"S"
],
"chemical_system": "Ag-Cd-Ga-S",
"density": 4.627981107456439,
"density_atomic": 0.04201509128157181,
"volume": 380.815547746239,
"volume_molar": 14.333280200777203,
"formula_full": "Cd4 Ga2 Ag2 S8",
"formula_reduced": "Cd2GaAgS4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.3707161356249999,
"spacegroup": 31
},
{
"id": "jvasp-11043",
"created_at": "2022-09-04T14:37:19.680077Z",
"updated_at": "2022-09-04T14:37:19.680090Z",
"structure_string": "Mg4 Ni4 O8\n1.0\n2.875858 0.004135 -0.000404\n1.413593 7.891427 0.419234\n1.428860 1.178476 8.218829\nMg Ni O\n4 4 8\ndirect\n0.363525 0.217484 0.052734 Mg\n0.636474 0.782517 0.947266 Mg\n0.070877 0.166845 0.693352 Mg\n0.929122 0.833156 0.306648 Mg\n0.642220 0.518489 0.198648 Ni\n0.251179 0.129723 0.367819 Ni\n0.748820 0.870278 0.632181 Ni\n0.357779 0.481513 0.801352 Ni\n0.798081 0.633888 0.769584 O\n0.342237 0.854451 0.460000 O\n0.657762 0.145550 0.540000 O\n0.201918 0.366114 0.230416 O\n0.088211 0.693189 0.133303 O\n0.868860 0.073766 0.185265 O\n0.911788 0.306812 0.866697 O\n0.131139 0.926236 0.814735 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Mg",
"Ni",
"O"
],
"chemical_system": "Mg-Ni-O",
"density": 4.1274529513016605,
"density_atomic": 0.08645811432489056,
"volume": 185.06070974293428,
"volume_molar": 6.965385270109085,
"formula_full": "Mg4 Ni4 O8",
"formula_reduced": "MgNiO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8252746124999999,
"spacegroup": 12
},
{
"id": "jvasp-36072",
"created_at": "2022-09-04T14:37:19.522694Z",
"updated_at": "2022-09-04T14:37:19.522725Z",
"structure_string": "U2 Cd4 O10\n1.0\n0.000000 -5.392595 0.000000\n2.061768 2.696297 5.500694\n-8.085124 0.000000 -0.065212\nU Cd O\n2 4 10\ndirect\n0.000000 0.000000 0.000000 U\n0.000001 0.000000 0.499999 U\n0.325138 0.694445 0.216943 Cd\n0.630693 0.305554 0.283056 Cd\n0.369308 0.694447 0.716943 Cd\n0.674862 0.305554 0.783057 Cd\n0.387478 0.185760 0.969559 O\n0.612522 0.814239 0.030439 O\n0.987148 0.328717 0.135859 O\n0.189172 0.000000 0.250000 O\n0.658432 0.671283 0.364141 O\n0.798284 0.185761 0.469561 O\n0.201718 0.814239 0.530440 O\n0.341569 0.328716 0.635858 O\n0.810825 0.999999 0.749998 O\n0.012851 0.671282 0.864140 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"U",
"Cd",
"O"
],
"chemical_system": "Cd-O-U",
"density": 7.5399805205015635,
"density_atomic": 0.06691645774273698,
"volume": 239.10410891013754,
"volume_molar": 8.999491250945116,
"formula_full": "U2 Cd4 O10",
"formula_reduced": "UCd2O5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 1.7904803750000002,
"spacegroup": 15
},
{
"id": "jvasp-23495",
"created_at": "2022-09-04T14:37:33.811001Z",
"updated_at": "2022-09-04T14:37:33.811022Z",
"structure_string": "Ti10 Sn6\n1.0\n4.031604 -6.982943 -0.000000\n4.031604 6.982943 -0.000000\n0.000000 0.000000 5.435944\nTi Sn\n10 6\ndirect\n-0.000000 0.758481 0.749999 Ti\n0.758481 0.758481 0.250000 Ti\n0.241518 -0.000000 0.250000 Ti\n0.758481 -0.000000 0.749999 Ti\n0.241518 0.241518 0.749999 Ti\n-0.000000 0.241518 0.250000 Ti\n0.333333 0.666666 0.000000 Ti\n0.666666 0.333333 0.500000 Ti\n0.666666 0.333333 0.000000 Ti\n0.333333 0.666666 0.500000 Ti\n-0.000000 0.390639 0.749999 Sn\n0.390639 0.390639 0.250000 Sn\n0.609360 -0.000000 0.250000 Sn\n0.390639 -0.000000 0.749999 Sn\n0.609360 0.609360 0.749999 Sn\n-0.000000 0.609360 0.250000 Sn\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Ti",
"Sn"
],
"chemical_system": "Sn-Ti",
"density": 6.461212115316199,
"density_atomic": 0.052275554535830764,
"volume": 306.07040216155457,
"volume_molar": 11.519994026791812,
"formula_full": "Ti10 Sn6",
"formula_reduced": "Ti5Sn3",
"formula_anonymous": "A3B5",
"energy_above_hull": 2.928373345833333,
"spacegroup": 193
},
{
"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-10922",
"created_at": "2022-09-04T14:37:18.953693Z",
"updated_at": "2022-09-04T14:37:18.953708Z",
"structure_string": "Mg2 V4 O10\n1.0\n0.000000 4.837904 -0.000236\n3.377147 0.000000 0.000000\n0.000000 -0.000687 -11.496709\nMg V O\n2 4 10\ndirect\n0.179170 0.500000 0.250021 Mg\n0.820829 0.000000 0.750018 Mg\n0.613638 0.000000 0.098739 V\n0.386353 0.500000 0.901258 V\n0.386354 0.500000 0.598736 V\n0.613650 0.000000 0.401261 V\n0.563224 0.500000 0.750000 O\n0.436775 0.000000 0.250001 O\n0.433800 0.500000 0.075012 O\n0.566205 0.000000 0.924980 O\n0.433797 0.500000 0.424980 O\n0.566196 0.000000 0.575012 O\n0.949163 0.000000 0.365500 O\n0.050847 0.500000 0.634493 O\n0.050842 0.500000 0.865493 O\n0.949148 0.000000 0.134500 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Mg",
"V",
"O"
],
"chemical_system": "Mg-O-V",
"density": 3.6454857832337972,
"density_atomic": 0.0851803129531226,
"volume": 187.83683042823876,
"volume_molar": 7.069873954694405,
"formula_full": "Mg2 V4 O10",
"formula_reduced": "MgV2O5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 2.57905811875,
"spacegroup": 59
},
{
"id": "jvasp-4258",
"created_at": "2022-09-04T14:37:33.815822Z",
"updated_at": "2022-09-04T14:37:33.815846Z",
"structure_string": "Mo4 Br12\n1.0\n6.074176 0.000000 0.000000\n0.000000 6.592487 0.000000\n0.000000 0.000000 11.406921\nMo Br\n4 12\ndirect\n0.728580 0.256358 0.500000 Mo\n0.228580 0.743642 0.000000 Mo\n0.271421 0.256358 0.500000 Mo\n0.771421 0.743642 0.000000 Mo\n0.500000 0.092765 0.663940 Br\n0.000000 0.907236 0.836060 Br\n0.500000 0.092765 0.336060 Br\n0.000000 0.907236 0.163940 Br\n0.000000 0.416367 0.000000 Br\n0.500000 0.583634 0.500000 Br\n0.500000 0.053507 0.000000 Br\n0.000000 0.946494 0.500000 Br\n0.000000 0.411152 0.345047 Br\n0.500000 0.588849 0.154953 Br\n0.000000 0.411152 0.654953 Br\n0.500000 0.588849 0.845047 Br\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Mo",
"Br"
],
"chemical_system": "Br-Mo",
"density": 4.880825047670257,
"density_atomic": 0.03502796404867136,
"volume": 456.77790401314786,
"volume_molar": 17.192380212655905,
"formula_full": "Mo4 Br12",
"formula_reduced": "MoBr3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.28975455375,
"spacegroup": 59
},
{
"id": "jvasp-50681",
"created_at": "2022-09-04T14:37:18.942988Z",
"updated_at": "2022-09-04T14:37:18.943014Z",
"structure_string": "Li4 Ag2 F10\n1.0\n-5.221233 -0.828547 0.000496\n3.481353 4.998463 -0.000998\n-0.000400 -0.002201 -8.759756\nLi Ag F\n4 2 10\ndirect\n0.147419 0.901542 0.922020 Li\n0.147452 0.901576 0.577997 Li\n-0.147464 0.098404 0.421989 Li\n-0.147454 0.098427 0.077996 Li\n0.680238 0.465538 0.250001 Ag\n0.319753 0.534465 0.750000 Ag\n0.557869 0.180272 0.408704 F\n0.557934 0.180348 0.091245 F\n0.825777 0.758395 0.409651 F\n0.825812 0.758423 0.090386 F\n0.897782 0.687891 0.750006 F\n0.102208 0.312076 0.249992 F\n0.174204 0.241601 0.909615 F\n0.174269 0.241642 0.590341 F\n0.442143 0.819739 0.591300 F\n0.442056 0.819652 0.908760 F\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Li",
"Ag",
"F"
],
"chemical_system": "Ag-F-Li",
"density": 3.539864746038868,
"density_atomic": 0.07868356861083163,
"volume": 203.34614052821988,
"volume_molar": 7.653619257898005,
"formula_full": "Li4 Ag2 F10",
"formula_reduced": "Li2AgF5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 0.0458100353125,
"spacegroup": 11
},
{
"id": "jvasp-9252",
"created_at": "2022-09-04T14:38:11.641024Z",
"updated_at": "2022-09-04T14:38:11.641055Z",
"structure_string": "Mg4 Sn4 O8\n1.0\n3.323118 0.001056 -0.125259\n0.350445 8.353781 -0.233796\n0.320090 2.749427 8.909850\nMg Sn O\n4 4 8\ndirect\n0.247237 0.350941 0.006380 Mg\n0.728523 0.677267 0.973535 Mg\n0.673808 0.123064 0.778702 Mg\n0.301967 0.905133 0.201222 Mg\n0.069844 0.579325 0.291238 Sn\n0.768230 0.204920 0.314712 Sn\n0.207537 0.823286 0.665200 Sn\n0.905914 0.448877 0.688679 Sn\n0.200181 0.588104 0.843632 O\n0.805117 0.810497 0.305328 O\n0.170655 0.217704 0.674595 O\n0.775582 0.440104 0.136281 O\n0.232615 0.741375 0.080801 O\n0.277652 0.143982 0.186340 O\n0.743144 0.286830 0.899116 O\n0.698114 0.884221 0.793572 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Mg",
"Sn",
"O"
],
"chemical_system": "Mg-O-Sn",
"density": 4.655653316855674,
"density_atomic": 0.06407951741760878,
"volume": 249.6897705350582,
"volume_molar": 9.397918403088882,
"formula_full": "Mg4 Sn4 O8",
"formula_reduced": "MgSnO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5957594374999999,
"spacegroup": 2
},
{
"id": "jvasp-56524",
"created_at": "2022-09-04T14:37:33.395033Z",
"updated_at": "2022-09-04T14:37:33.395054Z",
"structure_string": "V10 Si6\n1.0\n3.570049 -6.183507 0.000000\n3.570049 6.183507 -0.000000\n-0.000000 0.000000 4.845394\nV Si\n10 6\ndirect\n0.243580 0.243580 0.749999 V\n0.756420 -0.000000 0.749999 V\n-0.000000 0.243581 0.250000 V\n0.333333 0.666667 0.500000 V\n-0.000000 0.756420 0.749999 V\n0.666667 0.333333 0.500000 V\n0.243581 -0.000000 0.250000 V\n0.333333 0.666667 0.000000 V\n0.756420 0.756420 0.250000 V\n0.666667 0.333333 0.000000 V\n0.394839 0.394839 0.250000 Si\n-0.000000 0.605162 0.250000 Si\n-0.000000 0.394839 0.749999 Si\n0.605162 -0.000000 0.250000 Si\n0.605162 0.605162 0.749999 Si\n0.394839 -0.000000 0.749999 Si\n",
"nsites": 16,
"nelements": 2,
"elements": [
"V",
"Si"
],
"chemical_system": "Si-V",
"density": 5.262165979690701,
"density_atomic": 0.07479143329234236,
"volume": 213.92824412736832,
"volume_molar": 8.051912491716596,
"formula_full": "V10 Si6",
"formula_reduced": "V5Si3",
"formula_anonymous": "A3B5",
"energy_above_hull": 4.48585585,
"spacegroup": 193
},
{
"id": "jvasp-11037",
"created_at": "2022-09-04T14:37:18.934682Z",
"updated_at": "2022-09-04T14:37:18.934709Z",
"structure_string": "Mg4 Co4 O8\n1.0\n2.896002 -0.246552 -0.228912\n0.655948 7.282592 0.439434\n0.654279 0.774998 7.415307\nMg Co O\n4 4 8\ndirect\n0.762129 0.027917 0.793881 Mg\n0.261948 0.952001 0.177928 Mg\n0.262057 0.676146 0.938224 Mg\n0.761999 0.303766 0.033568 Mg\n0.262092 0.254213 0.390456 Co\n0.262177 0.402131 0.679002 Co\n0.761849 0.577786 0.292792 Co\n0.761968 0.725714 0.581342 Co\n0.261759 0.729770 0.388978 O\n0.261954 0.452183 0.157520 O\n0.762075 0.527734 0.814278 O\n0.762269 0.250136 0.582818 O\n0.761915 0.115636 0.266561 O\n0.262083 0.167627 0.918324 O\n0.262144 0.864289 0.705231 O\n-0.238026 0.812288 0.053483 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Mg",
"Co",
"O"
],
"chemical_system": "Co-Mg-O",
"density": 4.8595684401662735,
"density_atomic": 0.10158197960524153,
"volume": 157.50825158337844,
"volume_molar": 5.928355386853737,
"formula_full": "Mg4 Co4 O8",
"formula_reduced": "MgCoO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.3554067375000003,
"spacegroup": 11
},
{
"id": "jvasp-22834",
"created_at": "2022-09-04T14:37:34.424429Z",
"updated_at": "2022-09-04T14:37:34.424451Z",
"structure_string": "Hf6 Rh10\n1.0\n4.275767 0.000000 0.000000\n0.000000 5.604543 0.000000\n0.000000 0.000000 10.900977\nHf Rh\n6 10\ndirect\n0.500000 0.157303 0.645892 Hf\n0.500000 0.842696 0.354108 Hf\n0.500000 0.657303 0.854108 Hf\n0.500000 0.342696 0.145892 Hf\n0.000000 0.500000 0.500000 Hf\n0.000000 0.000000 0.000000 Hf\n0.500000 0.184648 0.892965 Rh\n0.500000 0.815351 0.107036 Rh\n0.500000 0.684648 0.607036 Rh\n0.500000 0.315351 0.392965 Rh\n0.000000 0.401506 0.742094 Rh\n0.000000 0.598493 0.257907 Rh\n0.000000 0.000000 0.500000 Rh\n0.000000 0.500000 0.000000 Rh\n0.000000 0.098493 0.242093 Rh\n0.000000 0.901506 0.757907 Rh\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Hf",
"Rh"
],
"chemical_system": "Hf-Rh",
"density": 13.348968190020015,
"density_atomic": 0.061249186188610014,
"volume": 261.2279606577921,
"volume_molar": 9.832197184556039,
"formula_full": "Hf6 Rh10",
"formula_reduced": "Hf3Rh5",
"formula_anonymous": "A3B5",
"energy_above_hull": 4.3850455,
"spacegroup": 55
}
]
}