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=updated_at&page=1051",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=updated_at&page=1049",
"results": [
{
"id": "jvasp-48109",
"created_at": "2022-09-04T14:36:15.710223Z",
"updated_at": "2022-09-04T14:36:15.710249Z",
"structure_string": "Li2 V2 Ge2 O10\n1.0\n6.497913 0.073717 0.000000\n0.073717 6.497913 -0.000000\n0.000000 -0.000000 4.550822\nLi V Ge O\n2 2 2 10\ndirect\n0.000000 0.500000 0.000000 Li\n0.500000 0.000000 0.000000 Li\n0.250000 0.250000 0.618033 V\n0.750000 0.750000 0.381967 V\n0.250000 0.750000 0.500000 Ge\n0.750000 0.250000 0.500000 Ge\n0.030375 0.742444 0.268885 O\n0.250000 0.250000 0.260477 O\n0.242445 0.530375 0.731115 O\n0.257556 0.969625 0.731115 O\n0.469625 0.757555 0.268885 O\n0.530375 0.242445 0.731115 O\n0.742444 0.030375 0.268885 O\n0.757555 0.469625 0.268885 O\n0.750000 0.750000 0.739523 O\n0.969625 0.257556 0.731115 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"V",
"Ge",
"O"
],
"chemical_system": "Ge-Li-O-V",
"density": 3.639063952422311,
"density_atomic": 0.08327952655674155,
"volume": 192.12405091062308,
"volume_molar": 7.231237987282365,
"formula_full": "Li2 V2 Ge2 O10",
"formula_reduced": "LiVGeO5",
"formula_anonymous": "ABCD5",
"energy_above_hull": 2.33892970625,
"spacegroup": 67
},
{
"id": "jvasp-75539",
"created_at": "2022-09-04T14:36:15.710270Z",
"updated_at": "2022-09-04T14:36:15.710290Z",
"structure_string": "Hf1 V2 As1\n1.0\n0.000000 3.149895 3.149895\n3.149895 0.000000 3.149895\n3.149895 3.149895 -0.000000\nHf V As\n1 2 1\ndirect\n0.750001 0.750001 0.750001 Hf\n0.000000 0.000000 0.000000 V\n0.250000 0.250000 0.250000 V\n0.500001 0.500001 0.500001 As\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"V",
"As"
],
"chemical_system": "As-Hf-V",
"density": 9.438858541662773,
"density_atomic": 0.06399436948522716,
"volume": 62.50549903337018,
"volume_molar": 9.41042283632498,
"formula_full": "Hf1 V2 As1",
"formula_reduced": "HfV2As",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.122968287500001,
"spacegroup": 216
},
{
"id": "jvasp-99363",
"created_at": "2022-09-04T14:36:15.713435Z",
"updated_at": "2022-09-04T14:36:15.713456Z",
"structure_string": "Li6 Sc2 B4 O12\n1.0\n4.783732 0.000000 -0.056889\n0.000000 5.925231 0.000000\n0.003123 0.000000 8.180458\nLi Sc B O\n6 2 4 12\ndirect\n0.515634 0.249440 0.203764 Li\n0.015634 0.250559 0.703764 Li\n0.984365 0.749440 0.296236 Li\n0.484365 0.750559 0.796236 Li\n0.000000 0.500000 0.000000 Li\n0.499999 0.000000 0.500000 Li\n0.499999 0.500000 0.500000 Sc\n0.000000 0.000000 0.000000 Sc\n0.985082 0.192856 0.375467 B\n0.514917 0.692856 0.124533 B\n0.014917 0.807143 0.624533 B\n0.485082 0.307144 0.875468 B\n0.231794 0.734533 0.111104 O\n0.631473 0.583671 0.259252 O\n0.131473 0.916328 0.759253 O\n0.812011 0.251849 0.504184 O\n0.687988 0.751849 0.995816 O\n0.268205 0.234533 0.388896 O\n0.368526 0.416329 0.740748 O\n0.187988 0.748151 0.495816 O\n0.312011 0.248151 0.004184 O\n0.868526 0.083671 0.240748 O\n0.768205 0.265467 0.888896 O\n0.731794 0.765467 0.611104 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Li",
"Sc",
"B",
"O"
],
"chemical_system": "B-Li-O-Sc",
"density": 2.626759676690359,
"density_atomic": 0.1035045694967746,
"volume": 231.87382080506006,
"volume_molar": 5.818236614362867,
"formula_full": "Li6 Sc2 B4 O12",
"formula_reduced": "Li3Sc(BO3)2",
"formula_anonymous": "AB2C3D6",
"energy_above_hull": 2.6245101180555555,
"spacegroup": 14
},
{
"id": "jvasp-1969",
"created_at": "2022-09-04T14:36:15.714259Z",
"updated_at": "2022-09-04T14:36:15.714271Z",
"structure_string": "Ca2 Br1 N1\n1.0\n3.580072 0.004804 6.216885\n1.665777 3.168931 6.216885\n0.007941 0.004804 7.174017\nCa Br N\n2 1 1\ndirect\n0.225956 0.225955 0.225957 Ca\n0.774045 0.774042 0.774047 Ca\n0.000000 0.000000 0.000000 Br\n0.500001 0.499998 0.500002 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Br",
"N"
],
"chemical_system": "Br-Ca-N",
"density": 3.5632409617768133,
"density_atomic": 0.04931061171616006,
"volume": 81.1184420713467,
"volume_molar": 12.212666909638896,
"formula_full": "Ca2 Br1 N1",
"formula_reduced": "Ca2BrN",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6397870487499999,
"spacegroup": 166
},
{
"id": "jvasp-1963",
"created_at": "2022-09-04T14:36:15.716200Z",
"updated_at": "2022-09-04T14:36:15.716226Z",
"structure_string": "Bi1 Te1 I1\n1.0\n2.201150 -3.812505 0.000000\n2.201150 3.812505 0.000000\n0.000000 0.000000 6.976162\nBi Te I\n1 1 1\ndirect\n0.333333 0.666667 0.920814 Bi\n0.000000 -0.000000 0.674130 Te\n0.666667 0.333333 0.224355 I\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Bi",
"Te",
"I"
],
"chemical_system": "Bi-I-Te",
"density": 6.5732181416425925,
"density_atomic": 0.02562209522103946,
"volume": 117.08644332632737,
"volume_molar": 23.503701426630197,
"formula_full": "Bi1 Te1 I1",
"formula_reduced": "BiTeI",
"formula_anonymous": "ABC",
"energy_above_hull": 0.3185194472222223,
"spacegroup": 156
},
{
"id": "jvasp-68802",
"created_at": "2022-09-04T14:36:15.720570Z",
"updated_at": "2022-09-04T14:36:15.720596Z",
"structure_string": "Be1 Mo1 Cl1\n1.0\n1.476792 -2.557881 0.000000\n1.476792 2.557881 -0.000000\n0.000000 0.000000 5.828474\nBe Mo Cl\n1 1 1\ndirect\n0.000000 -0.000000 0.018678 Be\n0.666666 0.333332 0.329265 Mo\n0.333332 0.666666 0.652057 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Mo",
"Cl"
],
"chemical_system": "Be-Cl-Mo",
"density": 5.294777419712785,
"density_atomic": 0.06812973952499647,
"volume": 44.033633783368785,
"volume_molar": 8.839224693924606,
"formula_full": "Be1 Mo1 Cl1",
"formula_reduced": "BeMoCl",
"formula_anonymous": "ABC",
"energy_above_hull": 2.4139686891666656,
"spacegroup": 156
},
{
"id": "jvasp-92702",
"created_at": "2022-09-04T14:36:15.730705Z",
"updated_at": "2022-09-04T14:36:15.730718Z",
"structure_string": "Ba1 Si3 Pd1\n1.0\n4.470384 -0.000000 -0.000000\n-0.000000 4.470384 -0.000000\n-2.235192 -2.235192 5.134740\nBa Si Pd\n1 3 1\ndirect\n0.615273 0.615273 0.230547 Ba\n0.002686 0.002686 0.005373 Si\n0.868807 0.368808 0.737615 Si\n0.368808 0.868807 0.737615 Si\n0.261125 0.261125 0.522250 Pd\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ba",
"Si",
"Pd"
],
"chemical_system": "Ba-Pd-Si",
"density": 5.307859976899784,
"density_atomic": 0.04872612628570602,
"volume": 102.61435458017863,
"volume_molar": 12.359161745567727,
"formula_full": "Ba1 Si3 Pd1",
"formula_reduced": "BaSi3Pd",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.210113494,
"spacegroup": 107
},
{
"id": "jvasp-42838",
"created_at": "2022-09-04T14:36:15.731594Z",
"updated_at": "2022-09-04T14:36:15.731620Z",
"structure_string": "Na8 Mn2 O8\n1.0\n5.607796 -0.001814 0.023008\n2.159542 5.414326 0.042317\n2.827471 0.700783 8.009434\nNa Mn O\n8 2 8\ndirect\n0.641614 0.002216 0.819506 Na\n0.115117 0.505323 0.869549 Na\n0.676386 0.552920 0.685485 Na\n0.202901 0.049763 0.635445 Na\n0.741000 0.043030 0.422463 Na\n0.924233 0.530144 0.276001 Na\n0.393793 0.024949 0.228974 Na\n0.577012 0.512084 0.082535 Na\n0.007430 0.996456 0.005129 Mn\n0.310565 0.558657 0.499853 Mn\n0.862009 0.251295 0.870579 O\n0.322107 0.784175 0.900780 O\n-0.004099 0.770951 0.604202 O\n0.455963 0.303820 0.634411 O\n0.513469 0.757247 0.450678 O\n0.319820 0.383432 0.345619 O\n0.804552 0.797843 0.054301 O\n-0.001826 0.171680 0.159364 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Na",
"Mn",
"O"
],
"chemical_system": "Mn-Na-O",
"density": 2.8854616348228324,
"density_atomic": 0.07415543811826823,
"volume": 242.733378114392,
"volume_molar": 8.1209698341954,
"formula_full": "Na8 Mn2 O8",
"formula_reduced": "Na4MnO4",
"formula_anonymous": "AB4C4",
"energy_above_hull": 1.2582030268199234,
"spacegroup": 2
},
{
"id": "jvasp-69796",
"created_at": "2022-09-04T14:36:15.732537Z",
"updated_at": "2022-09-04T14:36:15.732547Z",
"structure_string": "Na1 Mg1 Be2\n1.0\n2.893916 0.000000 0.000000\n0.000000 2.893916 0.000000\n0.000000 0.000000 7.760551\nNa Mg Be\n1 1 2\ndirect\n0.500001 0.500001 0.794259 Na\n0.000000 0.000000 0.433610 Mg\n0.000000 0.000000 0.085469 Be\n0.500001 0.500001 0.186663 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Mg",
"Be"
],
"chemical_system": "Be-Mg-Na",
"density": 1.6688800062299232,
"density_atomic": 0.06154539907599595,
"volume": 64.99267305198265,
"volume_molar": 9.784875637192457,
"formula_full": "Na1 Mg1 Be2",
"formula_reduced": "NaMgBe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6479096624999999,
"spacegroup": 99
},
{
"id": "jvasp-69716",
"created_at": "2022-09-04T14:36:15.736740Z",
"updated_at": "2022-09-04T14:36:15.736759Z",
"structure_string": "Mn1 Be2 In1\n1.0\n2.865821 0.000000 -0.000000\n0.000000 2.865821 0.000000\n0.000000 0.000000 6.226217\nMn Be In\n1 2 1\ndirect\n0.500000 0.500000 0.810947 Mn\n0.000000 0.000000 0.016868 Be\n0.500000 0.500000 0.180272 Be\n0.000000 0.000000 0.491915 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Be",
"In"
],
"chemical_system": "Be-In-Mn",
"density": 6.09785374438991,
"density_atomic": 0.07822356717797858,
"volume": 51.13548441097015,
"volume_molar": 7.698627123841198,
"formula_full": "Mn1 Be2 In1",
"formula_reduced": "MnBe2In",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.9310198528448272,
"spacegroup": 99
},
{
"id": "jvasp-90451",
"created_at": "2022-09-04T14:36:15.739350Z",
"updated_at": "2022-09-04T14:36:15.739381Z",
"structure_string": "K1 Mg6 Nb1\n1.0\n6.513631 0.000549 0.000000\n-3.256341 5.641245 0.000000\n0.000000 0.000000 5.107034\nK Mg Nb\n1 6 1\ndirect\n0.083335 0.416664 0.250000 K\n0.108133 0.929077 0.250000 Mg\n0.570922 0.391867 0.250000 Mg\n0.570995 0.929004 0.250000 Mg\n0.432519 0.591309 0.749999 Mg\n0.908690 0.067481 0.749999 Mg\n0.908722 0.591277 0.749999 Mg\n0.416682 0.083318 0.749999 Nb\n",
"nsites": 8,
"nelements": 3,
"elements": [
"K",
"Mg",
"Nb"
],
"chemical_system": "K-Mg-Nb",
"density": 2.458371770468137,
"density_atomic": 0.04262869083812203,
"volume": 187.66703463587842,
"volume_molar": 14.126966232363191,
"formula_full": "K1 Mg6 Nb1",
"formula_reduced": "KMg6Nb",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0006325000000008,
"spacegroup": 187
},
{
"id": "jvasp-49795",
"created_at": "2022-09-04T14:36:15.743461Z",
"updated_at": "2022-09-04T14:36:15.743487Z",
"structure_string": "Al4 O6\n1.0\n2.766472 4.887231 0.000000\n-2.766472 4.887231 0.000000\n0.000000 0.000000 4.968435\nAl O\n4 6\ndirect\n0.004455 0.330399 0.931403 Al\n0.669601 0.995545 0.931403 Al\n0.330399 0.004455 0.431403 Al\n0.995545 0.669601 0.431403 Al\n0.224666 0.775334 0.491003 O\n0.100316 0.339407 0.586967 O\n0.660593 0.899684 0.586967 O\n0.339407 0.100316 0.086966 O\n0.899684 0.660593 0.086966 O\n0.775334 0.224666 0.991004 O\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Al",
"O"
],
"chemical_system": "Al-O",
"density": 2.5204356048364005,
"density_atomic": 0.07443226689046359,
"volume": 134.35033511361752,
"volume_molar": 8.090766292073754,
"formula_full": "Al4 O6",
"formula_reduced": "Al2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.6173572200000002,
"spacegroup": 36
}
]
}