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=-nelements&page=939",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=937",
"results": [
{
"id": "jvasp-116229",
"created_at": "2022-09-04T14:38:41.944334Z",
"updated_at": "2022-09-04T14:38:41.944366Z",
"structure_string": "Na1 La1 Se2\n1.0\n2.182567 1.260106 6.878113\n-2.182567 1.260106 6.878113\n0.000000 -2.520212 6.878113\nNa La Se\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Na\n0.499999 0.499999 0.499999 La\n0.752633 0.752633 0.752633 Se\n0.247366 0.247366 0.247366 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"La",
"Se"
],
"chemical_system": "La-Na-Se",
"density": 4.6789998445353795,
"density_atomic": 0.03524234273886881,
"volume": 113.49983256329882,
"volume_molar": 17.087799198315427,
"formula_full": "Na1 La1 Se2",
"formula_reduced": "NaLaSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5216576833333334,
"spacegroup": 166
},
{
"id": "jvasp-112496",
"created_at": "2022-09-04T14:38:41.851664Z",
"updated_at": "2022-09-04T14:38:41.851698Z",
"structure_string": "Na4 Ti4 F16\n1.0\n5.374751 -0.000000 0.000000\n0.000000 7.519429 1.437541\n-0.000000 -0.054230 7.886615\nNa Ti F\n4 4 16\ndirect\n0.221830 0.378578 0.855002 Na\n0.721830 0.121422 0.144998 Na\n0.778170 0.621422 0.144997 Na\n0.278170 0.878579 0.855002 Na\n0.740015 0.195709 0.673231 Ti\n0.240015 0.304291 0.326768 Ti\n0.259985 0.804291 0.326768 Ti\n0.759985 0.695710 0.673231 Ti\n0.925698 0.207069 0.451367 F\n0.425698 0.292931 0.548632 F\n0.635690 0.944331 0.672809 F\n0.135690 0.555669 0.327190 F\n0.364310 0.055669 0.327190 F\n0.864310 0.444331 0.672809 F\n0.548943 0.186523 0.882642 F\n0.032597 0.115459 0.803443 F\n0.451057 0.813478 0.117357 F\n0.951057 0.686523 0.882642 F\n0.574301 0.707069 0.451367 F\n0.532597 0.384541 0.196556 F\n0.967403 0.884541 0.196556 F\n0.467403 0.615460 0.803443 F\n0.048943 0.313478 0.117357 F\n0.074302 0.792931 0.548632 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Na",
"Ti",
"F"
],
"chemical_system": "F-Na-Ti",
"density": 3.0561859906440096,
"density_atomic": 0.07519809742435192,
"volume": 319.1570109090009,
"volume_molar": 8.008368517645247,
"formula_full": "Na4 Ti4 F16",
"formula_reduced": "NaTiF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0421457415277777,
"spacegroup": 14
},
{
"id": "jvasp-114505",
"created_at": "2022-09-04T14:38:41.853856Z",
"updated_at": "2022-09-04T14:38:41.853882Z",
"structure_string": "Sr2 B1 O3\n1.0\n-1.850175 1.850175 8.239535\n1.850175 -1.850175 8.239535\n1.850175 1.850175 -8.239535\nSr B O\n2 1 3\ndirect\n0.628856 0.628856 0.000000 Sr\n0.371144 0.371144 0.000000 Sr\n0.000000 0.000000 0.000000 B\n0.500000 0.500000 0.000000 O\n0.079574 0.079574 0.000000 O\n0.920426 0.920426 0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sr",
"B",
"O"
],
"chemical_system": "B-O-Sr",
"density": 3.4448312126987424,
"density_atomic": 0.05318178860978574,
"volume": 112.82057555499303,
"volume_molar": 11.32368977693972,
"formula_full": "Sr2 B1 O3",
"formula_reduced": "Sr2BO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.5845242838888889,
"spacegroup": 139
},
{
"id": "jvasp-116128",
"created_at": "2022-09-04T14:38:41.864900Z",
"updated_at": "2022-09-04T14:38:41.864932Z",
"structure_string": "Li2 H2 O2\n1.0\n4.826323 -1.556036 0.506051\n4.826323 1.556036 0.506051\n-0.588098 0.000000 2.917085\nLi H O\n2 2 2\ndirect\n0.578289 0.578289 0.725152 Li\n0.285006 0.285006 -0.075896 Li\n0.886082 0.886082 0.533806 H\n0.061870 0.061870 0.197260 H\n0.904420 0.904420 0.863692 O\n0.152835 0.152835 0.378429 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Li",
"H",
"O"
],
"chemical_system": "H-Li-O",
"density": 1.7776844100946805,
"density_atomic": 0.1341069871416638,
"volume": 44.74039815436242,
"volume_molar": 4.4905495890669105,
"formula_full": "Li2 H2 O2",
"formula_reduced": "LiHO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.1561145000000002,
"spacegroup": 8
},
{
"id": "jvasp-112715",
"created_at": "2022-09-04T14:38:41.866730Z",
"updated_at": "2022-09-04T14:38:41.866759Z",
"structure_string": "Yb4 Sb4 O16\n1.0\n5.252073 -0.000000 0.000000\n0.000000 7.470918 1.055930\n-0.000000 -0.031949 7.785323\nYb Sb O\n4 4 16\ndirect\n0.721764 0.608080 0.642444 Yb\n0.278235 0.391920 0.357555 Yb\n0.778235 0.108080 0.642444 Yb\n0.221765 0.891920 0.357555 Yb\n0.775427 0.193647 0.156606 Sb\n0.224572 0.806353 0.843394 Sb\n0.275428 0.306353 0.843394 Sb\n0.724572 0.693647 0.156606 Sb\n0.504081 0.122260 0.330503 O\n0.495918 0.877740 0.669496 O\n0.527774 0.668973 0.379870 O\n0.472226 0.331027 0.620129 O\n0.027774 0.831027 0.620129 O\n0.972225 0.168973 0.379870 O\n0.394144 0.810498 0.071675 O\n0.615816 0.438125 0.160086 O\n0.884183 0.938126 0.160086 O\n0.115817 0.061875 0.839914 O\n0.004082 0.377740 0.669496 O\n0.384183 0.561875 0.839914 O\n0.105855 0.310498 0.071675 O\n0.894144 0.689503 0.928324 O\n0.605855 0.189502 0.928324 O\n-0.004082 0.622260 0.330503 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Yb",
"Sb",
"O"
],
"chemical_system": "O-Sb-Yb",
"density": 7.796962284708208,
"density_atomic": 0.07851959610959013,
"volume": 305.6561825216612,
"volume_molar": 7.6696023137903975,
"formula_full": "Yb4 Sb4 O16",
"formula_reduced": "YbSbO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.5925651333333335,
"spacegroup": 14
},
{
"id": "jvasp-111676",
"created_at": "2022-09-04T14:38:41.874584Z",
"updated_at": "2022-09-04T14:38:41.874614Z",
"structure_string": "Tb4 Ga4 Pd8\n1.0\n5.634044 0.000000 0.000000\n0.000000 7.157009 0.000000\n0.000000 0.000000 7.329721\nTb Ga Pd\n4 4 8\ndirect\n0.355091 0.750000 0.029020 Tb\n0.144908 0.750000 0.529020 Tb\n0.644908 0.250000 0.970980 Tb\n0.855091 0.250000 0.470980 Tb\n0.643417 0.750000 0.385190 Ga\n0.856582 0.750000 0.885189 Ga\n0.356583 0.250000 0.614810 Ga\n0.143417 0.250000 0.114810 Ga\n0.913055 0.550939 0.185425 Pd\n0.586944 0.949061 0.685425 Pd\n0.086945 0.050939 0.814575 Pd\n0.413055 0.449061 0.314575 Pd\n0.086945 0.449061 0.814575 Pd\n0.413055 0.050939 0.314575 Pd\n0.913055 0.949061 0.185425 Pd\n0.586944 0.550939 0.685425 Pd\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Tb",
"Ga",
"Pd"
],
"chemical_system": "Ga-Pd-Tb",
"density": 9.921768625172888,
"density_atomic": 0.054135324086890396,
"volume": 295.5556334034143,
"volume_molar": 11.124235167289493,
"formula_full": "Tb4 Ga4 Pd8",
"formula_reduced": "TbGaPd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.85494303125,
"spacegroup": 62
},
{
"id": "jvasp-116395",
"created_at": "2022-09-04T14:38:41.917867Z",
"updated_at": "2022-09-04T14:38:41.917893Z",
"structure_string": "Si1 Pb1 O3\n1.0\n3.737632 -0.000000 0.000000\n0.000000 3.737632 -0.000000\n-0.000000 0.000000 3.737632\nSi Pb O\n1 1 3\ndirect\n0.499999 0.499999 0.499999 Si\n0.000000 0.000000 0.000000 Pb\n0.000000 0.499999 0.499999 O\n0.499999 0.499999 0.000000 O\n0.499999 0.000000 0.499999 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Si",
"Pb",
"O"
],
"chemical_system": "O-Pb-Si",
"density": 9.009092905271835,
"density_atomic": 0.09575917289666398,
"volume": 52.2143189916189,
"volume_molar": 6.288839573101406,
"formula_full": "Si1 Pb1 O3",
"formula_reduced": "SiPbO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.867239984,
"spacegroup": 221
},
{
"id": "jvasp-116386",
"created_at": "2022-09-04T14:38:41.889084Z",
"updated_at": "2022-09-04T14:38:41.889103Z",
"structure_string": "Sb1 Pb1 O3\n1.0\n4.206687 -0.000000 0.000000\n-0.000000 4.206687 -0.000000\n-0.000000 -0.000000 4.206687\nSb Pb O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Sb\n0.000000 0.000000 0.000000 Pb\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sb",
"Pb",
"O"
],
"chemical_system": "O-Pb-Sb",
"density": 8.408561293683794,
"density_atomic": 0.06716598779009285,
"volume": 74.44243976022507,
"volume_molar": 8.96605701507792,
"formula_full": "Sb1 Pb1 O3",
"formula_reduced": "SbPbO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.6778034839999998,
"spacegroup": 221
},
{
"id": "jvasp-111802",
"created_at": "2022-09-04T14:38:41.906559Z",
"updated_at": "2022-09-04T14:38:41.906586Z",
"structure_string": "Mn1 Ga2 Ni9\n1.0\n3.583934 0.000000 -0.000000\n0.000000 3.583934 -0.000000\n-0.000000 -0.000000 10.646347\nMn Ga Ni\n1 2 9\ndirect\n0.000000 0.000000 0.000005 Mn\n0.000000 0.000000 0.333469 Ga\n0.000000 0.000000 0.666542 Ga\n0.499999 0.499999 0.000005 Ni\n0.499999 0.499999 0.332054 Ni\n0.499999 0.499999 0.667957 Ni\n0.499999 0.000000 0.164518 Ni\n0.499999 0.000000 0.500006 Ni\n0.499999 0.000000 0.835492 Ni\n0.000000 0.499999 0.164518 Ni\n0.000000 0.499999 0.500006 Ni\n0.000000 0.499999 0.835492 Ni\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Mn",
"Ga",
"Ni"
],
"chemical_system": "Ga-Mn-Ni",
"density": 8.774881145218389,
"density_atomic": 0.08775272716092336,
"volume": 136.74788679779797,
"volume_molar": 6.862625191074042,
"formula_full": "Mn1 Ga2 Ni9",
"formula_reduced": "MnGa2Ni9",
"formula_anonymous": "AB2C9",
"energy_above_hull": 1.2724477909482763,
"spacegroup": 123
},
{
"id": "jvasp-115252",
"created_at": "2022-09-04T14:38:41.914254Z",
"updated_at": "2022-09-04T14:38:41.914277Z",
"structure_string": "Na1 Pt1 O1\n1.0\n4.194506 0.000000 0.000000\n0.000000 4.194506 0.000000\n-0.000000 0.000000 16.042169\nNa Pt O\n1 1 1\ndirect\n0.000000 0.000000 0.275601 Na\n0.000000 0.000000 0.605774 Pt\n0.000000 0.000000 0.152064 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Na",
"Pt",
"O"
],
"chemical_system": "Na-O-Pt",
"density": 1.3771333817181046,
"density_atomic": 0.010629100847026248,
"volume": 282.24400569492417,
"volume_molar": 56.65710436536917,
"formula_full": "Na1 Pt1 O1",
"formula_reduced": "NaPtO",
"formula_anonymous": "ABC",
"energy_above_hull": 2.4908746333333336,
"spacegroup": 99
},
{
"id": "jvasp-112718",
"created_at": "2022-09-04T14:38:41.923945Z",
"updated_at": "2022-09-04T14:38:41.923971Z",
"structure_string": "Ca2 Sn4 O10\n1.0\n3.976189 0.000202 0.000000\n-1.988195 5.453028 0.000000\n0.000000 -0.000000 10.817760\nCa Sn O\n2 4 10\ndirect\n0.807030 0.614035 0.750000 Ca\n0.192970 0.385966 0.250000 Ca\n0.131502 0.262970 0.563271 Sn\n0.868498 0.737031 0.436728 Sn\n0.868498 0.737031 0.063272 Sn\n0.131502 0.262970 0.936729 Sn\n0.801154 0.602353 0.250000 O\n0.198846 0.397648 0.750000 O\n0.305849 0.611716 0.053202 O\n0.694152 0.388285 0.946798 O\n0.694152 0.388285 0.553202 O\n0.305849 0.611716 0.446797 O\n-0.047809 -0.095441 0.609710 O\n0.047809 0.095440 0.390290 O\n-0.047809 -0.095441 0.890290 O\n0.047809 0.095440 0.109711 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Ca",
"Sn",
"O"
],
"chemical_system": "Ca-O-Sn",
"density": 5.061729488338827,
"density_atomic": 0.06821342391553062,
"volume": 234.5579371563721,
"volume_molar": 8.828380712068169,
"formula_full": "Ca2 Sn4 O10",
"formula_reduced": "CaSn2O5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 1.554032395833333,
"spacegroup": 63
},
{
"id": "jvasp-116831",
"created_at": "2022-09-04T14:38:41.925550Z",
"updated_at": "2022-09-04T14:38:41.925578Z",
"structure_string": "Zn4 Co4 O8\n1.0\n2.980178 -0.000000 -0.000000\n-0.000001 8.545839 0.151962\n0.000000 0.125372 6.124620\nZn Co O\n4 4 8\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 0.250000 0.750000 Zn\n0.000000 0.500000 0.500000 Zn\n0.500001 0.750000 0.250000 Zn\n-0.000000 -0.000000 0.500000 Co\n0.500000 0.250000 0.250000 Co\n0.000000 0.500000 -0.000000 Co\n0.500001 0.750000 0.750000 Co\n0.000000 0.249948 0.499901 O\n0.500000 0.499948 0.249901 O\n0.000000 0.749948 -0.000100 O\n0.500000 -0.000052 0.749901 O\n0.000000 0.750052 0.500099 O\n0.500000 0.000052 0.250099 O\n0.000000 0.250052 0.000099 O\n0.500000 0.500052 0.750099 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Zn",
"Co",
"O"
],
"chemical_system": "Co-O-Zn",
"density": 6.659843338545944,
"density_atomic": 0.10261291745810358,
"volume": 155.9257878671341,
"volume_molar": 5.868794016561135,
"formula_full": "Zn4 Co4 O8",
"formula_reduced": "ZnCoO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.3592845749999998,
"spacegroup": 166
}
]
}