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=-formula_anonymous&page=345",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=343",
"results": [
{
"id": "jvasp-66125",
"created_at": "2022-09-04T14:36:19.273423Z",
"updated_at": "2022-09-04T14:36:19.273442Z",
"structure_string": "Ba4 Mn1 P1\n1.0\n0.000000 4.837748 4.837748\n4.837748 0.000000 4.837748\n4.837748 4.837748 -0.000000\nBa Mn P\n4 1 1\ndirect\n0.123294 0.625569 0.625569 Ba\n0.625569 0.625569 0.625569 Ba\n0.625569 0.123294 0.625569 Ba\n0.625569 0.625569 0.123294 Ba\n0.250000 0.250000 0.250000 Mn\n0.000000 0.000000 0.000000 P\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Mn",
"P"
],
"chemical_system": "Ba-Mn-P",
"density": 4.658149331921614,
"density_atomic": 0.02649668413216791,
"volume": 226.44342854643415,
"volume_molar": 22.72790334806048,
"formula_full": "Ba4 Mn1 P1",
"formula_reduced": "Ba4MnP",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.3273177702298848,
"spacegroup": 216
},
{
"id": "jvasp-64408",
"created_at": "2022-09-04T14:36:13.748565Z",
"updated_at": "2022-09-04T14:36:13.748590Z",
"structure_string": "Ba4 Ti1 Hg1\n1.0\n0.000000 4.996039 4.996039\n4.996039 0.000000 4.996039\n4.996039 4.996039 0.000000\nBa Ti Hg\n4 1 1\ndirect\n0.125100 0.624967 0.624967 Ba\n0.624967 0.624967 0.624967 Ba\n0.624967 0.125100 0.624967 Ba\n0.624967 0.624967 0.125100 Ba\n0.000000 0.000000 0.000000 Ti\n0.250000 0.250000 0.250000 Hg\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Ti",
"Hg"
],
"chemical_system": "Ba-Hg-Ti",
"density": 5.3114930908110445,
"density_atomic": 0.0240571288911036,
"volume": 249.40632056133757,
"volume_molar": 25.032666147567618,
"formula_full": "Ba4 Ti1 Hg1",
"formula_reduced": "Ba4TiHg",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.3510761355555555,
"spacegroup": 216
},
{
"id": "jvasp-63900",
"created_at": "2022-09-04T14:36:13.772930Z",
"updated_at": "2022-09-04T14:36:13.772952Z",
"structure_string": "Ba4 Tc1 Mo1\n1.0\n0.000000 4.823744 4.823744\n4.823744 0.000000 4.823744\n4.823744 4.823744 -0.000000\nBa Tc Mo\n4 1 1\ndirect\n0.124394 0.625202 0.625202 Ba\n0.625202 0.625202 0.625202 Ba\n0.625202 0.124394 0.625202 Ba\n0.625202 0.625202 0.124394 Ba\n0.000000 0.000000 0.000000 Tc\n0.250000 0.250000 0.250000 Mo\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Tc",
"Mo"
],
"chemical_system": "Ba-Mo-Tc",
"density": 5.4979412771911855,
"density_atomic": 0.02672812542212133,
"volume": 224.48263412570438,
"volume_molar": 22.531100348009524,
"formula_full": "Ba4 Tc1 Mo1",
"formula_reduced": "Ba4TcMo",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.212545213333333,
"spacegroup": 216
},
{
"id": "jvasp-66508",
"created_at": "2022-09-04T14:36:13.781806Z",
"updated_at": "2022-09-04T14:36:13.781831Z",
"structure_string": "Ba4 Mn1 Tc1\n1.0\n-0.000000 4.879388 4.879388\n4.879388 -0.000000 4.879388\n4.879388 4.879388 -0.000000\nBa Mn Tc\n4 1 1\ndirect\n0.123597 0.625468 0.625468 Ba\n0.625468 0.625468 0.625468 Ba\n0.625468 0.123597 0.625468 Ba\n0.625468 0.625468 0.123597 Ba\n0.250000 0.250000 0.250000 Mn\n0.000000 0.000000 0.000000 Tc\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Mn",
"Tc"
],
"chemical_system": "Ba-Mn-Tc",
"density": 5.018943912549567,
"density_atomic": 0.025824099915035044,
"volume": 232.34110848938982,
"volume_molar": 23.319847660958942,
"formula_full": "Ba4 Mn1 Tc1",
"formula_reduced": "Ba4MnTc",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.8393004368965515,
"spacegroup": 216
},
{
"id": "jvasp-66553",
"created_at": "2022-09-04T14:36:16.340415Z",
"updated_at": "2022-09-04T14:36:16.340435Z",
"structure_string": "Ba4 Cd1 Rh1\n1.0\n0.000000 4.851116 4.851116\n4.851116 -0.000000 4.851116\n4.851116 4.851116 -0.000000\nBa Cd Rh\n4 1 1\ndirect\n0.122634 0.625790 0.625790 Ba\n0.625790 0.625790 0.625790 Ba\n0.625790 0.122634 0.625790 Ba\n0.625790 0.625790 0.122634 Ba\n0.250000 0.250000 0.250000 Cd\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Cd",
"Rh"
],
"chemical_system": "Ba-Cd-Rh",
"density": 5.560864751073997,
"density_atomic": 0.026278240069364363,
"volume": 228.3257929055495,
"volume_molar": 22.916834400263806,
"formula_full": "Ba4 Cd1 Rh1",
"formula_reduced": "Ba4CdRh",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.1111877716666666,
"spacegroup": 216
},
{
"id": "jvasp-65083",
"created_at": "2022-09-04T14:36:09.154534Z",
"updated_at": "2022-09-04T14:36:09.154558Z",
"structure_string": "Be1 V1 Cu4\n1.0\n0.000000 3.363190 3.363190\n3.363190 -0.000000 3.363190\n3.363190 3.363190 -0.000000\nBe V Cu\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 V\n0.124033 0.625322 0.625322 Cu\n0.625322 0.625322 0.625322 Cu\n0.625322 0.124033 0.625322 Cu\n0.625322 0.625322 0.124033 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"V",
"Cu"
],
"chemical_system": "Be-Cu-V",
"density": 6.8562228867825645,
"density_atomic": 0.0788618653913798,
"volume": 76.08240015909952,
"volume_molar": 7.636315385279062,
"formula_full": "Be1 V1 Cu4",
"formula_reduced": "BeVCu4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.8823070166666669,
"spacegroup": 216
},
{
"id": "jvasp-66318",
"created_at": "2022-09-04T14:36:16.547132Z",
"updated_at": "2022-09-04T14:36:16.547153Z",
"structure_string": "Ba4 Si1 Mo1\n1.0\n0.000000 4.882071 4.882071\n4.882071 0.000000 4.882071\n4.882071 4.882071 0.000000\nBa Si Mo\n4 1 1\ndirect\n0.122752 0.625750 0.625750 Ba\n0.625750 0.625750 0.625750 Ba\n0.625750 0.122752 0.625750 Ba\n0.625750 0.625750 0.122752 Ba\n0.000000 0.000000 0.000000 Si\n0.250000 0.250000 0.250000 Mo\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Si",
"Mo"
],
"chemical_system": "Ba-Mo-Si",
"density": 4.804376685776103,
"density_atomic": 0.025781547487957586,
"volume": 232.72458733528566,
"volume_molar": 23.358337054100062,
"formula_full": "Ba4 Si1 Mo1",
"formula_reduced": "Ba4SiMo",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.6950747299999995,
"spacegroup": 216
},
{
"id": "jvasp-64510",
"created_at": "2022-09-04T14:36:19.168022Z",
"updated_at": "2022-09-04T14:36:19.168056Z",
"structure_string": "Ba4 Li1 Ni1\n1.0\n0.000000 5.070232 5.070232\n5.070232 0.000000 5.070232\n5.070232 5.070232 0.000000\nBa Li Ni\n4 1 1\ndirect\n0.121217 0.626261 0.626261 Ba\n0.626261 0.626261 0.626261 Ba\n0.626261 0.121217 0.626261 Ba\n0.626261 0.626261 0.121217 Ba\n0.250000 0.250000 0.250000 Li\n0.000000 0.000000 0.000000 Ni\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Li",
"Ni"
],
"chemical_system": "Ba-Li-Ni",
"density": 3.917148576323447,
"density_atomic": 0.023016419208633655,
"volume": 260.683468858151,
"volume_molar": 26.164542387814365,
"formula_full": "Ba4 Li1 Ni1",
"formula_reduced": "Ba4LiNi",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.2655360466666666,
"spacegroup": 216
},
{
"id": "jvasp-93953",
"created_at": "2022-09-04T14:36:13.908188Z",
"updated_at": "2022-09-04T14:36:13.908215Z",
"structure_string": "Cr1 Sb1 O4\n1.0\n3.125880 0.000000 0.000000\n0.000000 4.606912 -0.051891\n0.000000 -0.051891 4.606912\nCr Sb O\n1 1 4\ndirect\n0.500000 0.500000 0.500000 Cr\n0.000000 0.000000 0.000000 Sb\n0.000000 0.691378 0.691378 O\n0.500000 0.197340 0.802660 O\n0.500000 0.802660 0.197340 O\n0.000000 0.308621 0.308621 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Cr",
"Sb",
"O"
],
"chemical_system": "Cr-O-Sb",
"density": 5.951676947017449,
"density_atomic": 0.09045117618452789,
"volume": 66.33412911911176,
"volume_molar": 6.657891045788431,
"formula_full": "Cr1 Sb1 O4",
"formula_reduced": "CrSbO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.669539583333334,
"spacegroup": 65
},
{
"id": "jvasp-63455",
"created_at": "2022-09-04T14:36:11.458169Z",
"updated_at": "2022-09-04T14:36:11.458196Z",
"structure_string": "Ga3 As3 O12\n1.0\n2.496032 -4.323272 0.000013\n2.496075 4.323296 -0.000043\n-0.000073 -0.000076 11.569002\nGa As O\n3 3 12\ndirect\n-0.000003 0.553296 0.333326 Ga\n0.446702 0.446704 0.666657 Ga\n0.553297 0.000001 0.999990 Ga\n0.000000 0.555921 0.833325 As\n0.444078 0.444079 0.166656 As\n0.555925 0.000001 0.499990 As\n0.390198 0.087676 0.129962 O\n0.609797 0.697476 0.536688 O\n0.087678 0.390205 0.203352 O\n0.302531 0.912323 0.870019 O\n0.931199 0.323937 0.952324 O\n0.607263 0.676068 0.047659 O\n0.392739 0.068799 0.618991 O\n0.697473 0.609788 0.796629 O\n0.068797 0.392743 0.714322 O\n0.323944 0.931199 0.380989 O\n0.676053 0.607251 0.285660 O\n0.912322 0.302527 0.463295 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ga",
"As",
"O"
],
"chemical_system": "As-Ga-O",
"density": 4.162736859204959,
"density_atomic": 0.07209065276814298,
"volume": 249.6856292575317,
"volume_molar": 8.35356669521128,
"formula_full": "Ga3 As3 O12",
"formula_reduced": "GaAsO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.8749063458333337,
"spacegroup": 152
},
{
"id": "jvasp-64497",
"created_at": "2022-09-04T14:36:14.016083Z",
"updated_at": "2022-09-04T14:36:14.016107Z",
"structure_string": "Ba4 Li1 Co1\n1.0\n-0.000000 5.024921 5.024921\n5.024921 0.000000 5.024921\n5.024921 5.024921 0.000000\nBa Li Co\n4 1 1\ndirect\n0.128819 0.623727 0.623727 Ba\n0.623727 0.623727 0.623727 Ba\n0.623727 0.128819 0.623727 Ba\n0.623727 0.623727 0.128819 Ba\n0.000000 0.000000 0.000000 Li\n0.250000 0.250000 0.250000 Co\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Li",
"Co"
],
"chemical_system": "Ba-Co-Li",
"density": 4.025641941348627,
"density_atomic": 0.02364468538807982,
"volume": 253.75681264191516,
"volume_molar": 25.469320742309343,
"formula_full": "Ba4 Li1 Co1",
"formula_reduced": "Ba4LiCo",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.7124391299999999,
"spacegroup": 216
},
{
"id": "jvasp-66239",
"created_at": "2022-09-04T14:36:22.158544Z",
"updated_at": "2022-09-04T14:36:22.158568Z",
"structure_string": "Ba4 Fe1 Bi1\n1.0\n0.000000 4.935248 4.935248\n4.935248 0.000000 4.935248\n4.935248 4.935248 -0.000000\nBa Fe Bi\n4 1 1\ndirect\n0.125450 0.624850 0.624850 Ba\n0.624850 0.624850 0.624850 Ba\n0.624850 0.125450 0.624850 Ba\n0.624850 0.624850 0.125450 Ba\n0.000000 0.000000 0.000000 Fe\n0.250000 0.250000 0.250000 Bi\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Fe",
"Bi"
],
"chemical_system": "Ba-Bi-Fe",
"density": 5.623254382346985,
"density_atomic": 0.024957111032282736,
"volume": 240.41244165796388,
"volume_molar": 24.129959401992437,
"formula_full": "Ba4 Fe1 Bi1",
"formula_reduced": "Ba4FeBi",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.7472272799999998,
"spacegroup": 216
}
]
}