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=-volume_molar&page=3996",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume_molar&page=3994",
"results": [
{
"id": "jvasp-63844",
"created_at": "2022-09-04T14:35:48.936910Z",
"updated_at": "2022-09-04T14:35:48.936936Z",
"structure_string": "U1 B2\n1.0\n1.547419 -2.680077 0.000000\n1.547419 2.680077 0.000000\n0.000000 0.000000 4.041248\nU B\n1 2\ndirect\n0.000000 0.000000 0.000000 U\n0.333333 0.666667 0.500000 B\n0.666667 0.333333 0.500000 B\n",
"nsites": 3,
"nelements": 2,
"elements": [
"U",
"B"
],
"chemical_system": "B-U",
"density": 12.862880986675576,
"density_atomic": 0.08949948980458869,
"volume": 33.519744152174916,
"volume_molar": 6.728687250786141,
"formula_full": "U1 B2",
"formula_reduced": "UB2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.2216003888888896,
"spacegroup": 191
},
{
"id": "jvasp-116939",
"created_at": "2022-09-04T14:38:48.124972Z",
"updated_at": "2022-09-04T14:38:48.124998Z",
"structure_string": "Co4 Bi4 O12\n1.0\n5.342710 -0.000000 0.000000\n0.000000 5.513030 0.000000\n-0.000000 -0.000000 7.586729\nCo Bi O\n4 4 12\ndirect\n0.500000 0.000000 -0.000000 Co\n-0.000000 0.500000 0.500000 Co\n0.500000 0.000000 0.500000 Co\n-0.000000 0.500000 -0.000000 Co\n0.510181 0.555292 0.250000 Bi\n0.989819 0.055292 0.250000 Bi\n0.489819 0.444708 0.750000 Bi\n0.010181 0.944708 0.750000 Bi\n0.296878 0.706580 0.541454 O\n0.203122 0.206580 0.958546 O\n0.296878 0.706580 0.958546 O\n0.203122 0.206580 0.541454 O\n0.703122 0.293420 0.458546 O\n0.083541 0.474891 0.250000 O\n0.916459 0.525109 0.750000 O\n0.583541 0.025109 0.750000 O\n0.796878 0.793420 0.458546 O\n0.416459 0.974891 0.250000 O\n0.796878 0.793420 0.041454 O\n0.703122 0.293420 0.041454 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Co",
"Bi",
"O"
],
"chemical_system": "Bi-Co-O",
"density": 9.390060739070371,
"density_atomic": 0.0895000889966348,
"volume": 223.46346494417455,
"volume_molar": 6.728642203055723,
"formula_full": "Co4 Bi4 O12",
"formula_reduced": "CoBiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.184717139999999,
"spacegroup": 62
},
{
"id": "jvasp-74538",
"created_at": "2022-09-04T14:36:04.544754Z",
"updated_at": "2022-09-04T14:36:04.544782Z",
"structure_string": "Be2 Si1 Os1\n1.0\n3.028009 0.000000 0.000000\n0.000000 3.028009 -0.000000\n0.000000 -0.000000 4.874160\nBe Si Os\n2 1 1\ndirect\n0.000000 0.000000 0.014099 Be\n0.500000 0.500000 0.230024 Be\n0.500000 0.500000 0.757638 Si\n0.000000 0.000000 0.498239 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Si",
"Os"
],
"chemical_system": "Be-Os-Si",
"density": 8.781566088821034,
"density_atomic": 0.08950470936785926,
"volume": 44.69038588305145,
"volume_molar": 6.728294860161317,
"formula_full": "Be2 Si1 Os1",
"formula_reduced": "Be2SiOs",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.14963895,
"spacegroup": 99
},
{
"id": "jvasp-71886",
"created_at": "2022-09-04T14:36:15.969580Z",
"updated_at": "2022-09-04T14:36:15.969605Z",
"structure_string": "Be1 Zn1 Fe2\n1.0\n-1.748093 1.748093 3.656135\n1.748093 -1.748093 3.656135\n1.748093 1.748093 -3.656135\nBe Zn Fe\n1 1 2\ndirect\n0.749999 0.250000 0.499999 Be\n0.250000 0.749999 0.499999 Zn\n0.000000 0.000000 0.000000 Fe\n0.499999 0.499999 0.000000 Fe\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Zn",
"Fe"
],
"chemical_system": "Be-Fe-Zn",
"density": 6.91528817257899,
"density_atomic": 0.08950529105903035,
"volume": 44.69009544208876,
"volume_molar": 6.728251133252323,
"formula_full": "Be1 Zn1 Fe2",
"formula_reduced": "BeZnFe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.7791343749999995,
"spacegroup": 139
},
{
"id": "jvasp-50852",
"created_at": "2022-09-04T14:37:15.636143Z",
"updated_at": "2022-09-04T14:37:15.636168Z",
"structure_string": "Zr4 Ti4 O16\n1.0\n4.940857 -0.046041 -0.025044\n-0.062264 5.412388 -0.212554\n-0.365520 -0.441439 10.046221\nZr Ti O\n4 4 16\ndirect\n0.039002 0.727813 0.892200 Zr\n0.966866 0.287494 0.111363 Zr\n0.019360 0.710304 0.391492 Zr\n0.454893 0.212479 0.395796 Zr\n-0.004308 0.299784 0.627945 Ti\n0.493222 0.188291 0.870006 Ti\n0.512106 0.827041 0.133183 Ti\n0.539368 0.786895 0.624991 Ti\n0.805219 0.395487 0.471762 O\n0.760042 0.628560 0.210310 O\n0.684550 0.131553 0.224950 O\n0.728443 0.122249 0.710481 O\n0.742935 0.943326 0.985005 O\n0.675442 0.886665 0.463960 O\n0.255674 0.072246 0.006990 O\n0.233217 0.376462 0.786843 O\n0.252469 0.908307 0.269469 O\n0.329327 0.874318 0.775406 O\n0.758845 0.421999 0.947296 O\n0.196961 0.403632 0.283011 O\n0.292072 0.538260 0.536070 O\n0.249342 0.588628 0.044778 O\n0.195756 0.040357 0.530828 O\n0.819212 0.627850 0.705875 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Zr",
"Ti",
"O"
],
"chemical_system": "O-Ti-Zr",
"density": 5.031350531756734,
"density_atomic": 0.08951610614956457,
"volume": 268.10817664365914,
"volume_molar": 6.727438244396082,
"formula_full": "Zr4 Ti4 O16",
"formula_reduced": "ZrTiO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.710981138888889,
"spacegroup": 1
},
{
"id": "jvasp-19914",
"created_at": "2022-09-04T14:36:46.798168Z",
"updated_at": "2022-09-04T14:36:46.798193Z",
"structure_string": "Ba1 B6\n1.0\n4.276230 0.000000 -0.000000\n0.000000 4.276230 0.000000\n0.000000 0.000000 4.276230\nBa B\n1 6\ndirect\n0.000000 0.000000 0.000000 Ba\n0.205282 0.500000 0.500000 B\n0.500000 0.500000 0.794718 B\n0.500000 0.500000 0.205282 B\n0.500000 0.205282 0.500000 B\n0.500000 0.794718 0.500000 B\n0.794718 0.500000 0.500000 B\n",
"nsites": 7,
"nelements": 2,
"elements": [
"Ba",
"B"
],
"chemical_system": "B-Ba",
"density": 4.293703445123679,
"density_atomic": 0.08951892783636042,
"volume": 78.19575333605336,
"volume_molar": 6.727226191770756,
"formula_full": "Ba1 B6",
"formula_reduced": "BaB6",
"formula_anonymous": "AB6",
"energy_above_hull": 4.272965924285714,
"spacegroup": 221
},
{
"id": "jvasp-42094",
"created_at": "2022-09-04T14:37:47.006377Z",
"updated_at": "2022-09-04T14:37:47.006397Z",
"structure_string": "Li1 Tc1 O3\n1.0\n3.822471 -0.000000 -0.000000\n0.000000 3.822471 0.000000\n0.000000 0.000000 3.822471\nLi Tc O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Tc\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": [
"Li",
"Tc",
"O"
],
"chemical_system": "Li-O-Tc",
"density": 4.547108465953837,
"density_atomic": 0.08952357290486927,
"volume": 55.8512114492254,
"volume_molar": 6.72687713927518,
"formula_full": "Li1 Tc1 O3",
"formula_reduced": "LiTcO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.5034024,
"spacegroup": 221
},
{
"id": "jvasp-15120",
"created_at": "2022-09-04T14:36:35.684446Z",
"updated_at": "2022-09-04T14:36:35.684466Z",
"structure_string": "Cr3 Ga1 N1\n1.0\n3.822468 -0.000000 -0.000000\n0.000000 3.822468 -0.000000\n0.000000 0.000000 3.822468\nCr Ga N\n3 1 1\ndirect\n0.500000 0.000000 0.500000 Cr\n0.000000 0.500000 0.500000 Cr\n0.500000 0.500000 0.000000 Cr\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.500000 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Cr",
"Ga",
"N"
],
"chemical_system": "Cr-Ga-N",
"density": 7.127187233254723,
"density_atomic": 0.0895237836882659,
"volume": 55.851079947767694,
"volume_molar": 6.72686130086941,
"formula_full": "Cr3 Ga1 N1",
"formula_reduced": "Cr3GaN",
"formula_anonymous": "ABC3",
"energy_above_hull": 4.004981554999999,
"spacegroup": 221
},
{
"id": "jvasp-36161",
"created_at": "2022-09-04T14:37:29.568142Z",
"updated_at": "2022-09-04T14:37:29.568163Z",
"structure_string": "Cr1 Ni3\n1.0\n3.548445 0.000000 -0.000000\n0.000000 3.548445 -0.000000\n-0.000000 -0.000000 3.548445\nCr Ni\n1 3\ndirect\n0.000000 0.000000 0.000000 Cr\n0.000000 0.499999 0.499999 Ni\n0.499999 0.499999 0.000000 Ni\n0.499999 0.000000 0.499999 Ni\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cr",
"Ni"
],
"chemical_system": "Cr-Ni",
"density": 8.476469856253606,
"density_atomic": 0.08952529419303411,
"volume": 44.680110085706225,
"volume_molar": 6.726747802710464,
"formula_full": "Cr1 Ni3",
"formula_reduced": "CrNi3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.9699661500000003,
"spacegroup": 221
},
{
"id": "jvasp-11695",
"created_at": "2022-09-04T14:38:09.220898Z",
"updated_at": "2022-09-04T14:38:09.220910Z",
"structure_string": "Mg2 W2 O8\n1.0\n0.000000 4.707838 -0.028385\n5.726189 0.000000 0.000000\n0.000000 -0.073123 -4.971620\nMg W O\n2 2 8\ndirect\n0.500000 0.330179 0.250000 Mg\n0.500001 0.669821 0.750000 Mg\n0.000000 0.818785 0.250000 W\n0.000001 0.181215 0.750000 W\n0.258130 0.377681 0.900930 O\n0.741871 0.377681 0.599069 O\n0.741871 0.622319 0.099069 O\n0.258130 0.622319 0.400930 O\n0.217078 0.892102 0.934758 O\n0.782924 0.892102 0.565242 O\n0.782923 0.107898 0.065242 O\n0.217078 0.107898 0.434758 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Mg",
"W",
"O"
],
"chemical_system": "Mg-O-W",
"density": 6.742981941572726,
"density_atomic": 0.08952773966660571,
"volume": 134.03666891051935,
"volume_molar": 6.726564059838862,
"formula_full": "Mg2 W2 O8",
"formula_reduced": "MgWO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.655912175,
"spacegroup": 13
},
{
"id": "jvasp-74339",
"created_at": "2022-09-04T14:36:18.665464Z",
"updated_at": "2022-09-04T14:36:18.665485Z",
"structure_string": "Be2 V1 Os1\n1.0\n2.943055 0.000000 0.000000\n0.000000 2.943055 0.000000\n0.000000 0.000000 5.158266\nBe V Os\n2 1 1\ndirect\n0.000000 0.000000 0.774603 Be\n0.000000 0.000000 0.225398 Be\n0.500001 0.500001 0.500000 V\n0.500001 0.500001 0.000000 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"V",
"Os"
],
"chemical_system": "Be-Os-V",
"density": 9.633335242591842,
"density_atomic": 0.08952812740747279,
"volume": 44.67869613528994,
"volume_molar": 6.726534927499601,
"formula_full": "Be2 V1 Os1",
"formula_reduced": "Be2VOs",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.4757578500000004,
"spacegroup": 123
},
{
"id": "jvasp-73523",
"created_at": "2022-09-04T14:36:01.066734Z",
"updated_at": "2022-09-04T14:36:01.066746Z",
"structure_string": "Be2 Ir1 Os1\n1.0\n2.804222 0.000000 0.000000\n0.000000 2.804222 0.000000\n0.000000 0.000000 5.681350\nBe Ir Os\n2 1 1\ndirect\n0.000000 0.000000 0.030497 Be\n0.500000 0.500000 0.221146 Be\n0.000000 0.000000 0.457552 Ir\n0.500000 0.500000 0.790806 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Ir",
"Os"
],
"chemical_system": "Be-Ir-Os",
"density": 14.884842213603367,
"density_atomic": 0.0895331083215095,
"volume": 44.67621056599726,
"volume_molar": 6.726160716295869,
"formula_full": "Be2 Ir1 Os1",
"formula_reduced": "Be2IrOs",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.488067075,
"spacegroup": 99
}
]
}