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=-density&page=1535",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density&page=1533",
"results": [
{
"id": "jvasp-67565",
"created_at": "2022-09-04T14:35:52.758108Z",
"updated_at": "2022-09-04T14:35:52.758139Z",
"structure_string": "K1 Be1 Ir1\n1.0\n-1.559147 1.559147 5.757535\n1.559147 -1.559147 5.757535\n1.559147 1.559147 -5.757535\nK Be Ir\n1 1 1\ndirect\n0.670896 0.670896 0.000000 K\n0.931436 0.931436 0.000000 Be\n0.397665 0.397665 0.000000 Ir\n",
"nsites": 3,
"nelements": 3,
"elements": [
"K",
"Be",
"Ir"
],
"chemical_system": "Be-Ir-K",
"density": 7.128232044783074,
"density_atomic": 0.053585902537514635,
"volume": 55.98487396754674,
"volume_molar": 11.238293048780873,
"formula_full": "K1 Be1 Ir1",
"formula_reduced": "KBeIr",
"formula_anonymous": "ABC",
"energy_above_hull": 1.6219450666666662,
"spacegroup": 107
},
{
"id": "jvasp-38481",
"created_at": "2022-09-04T14:37:51.249403Z",
"updated_at": "2022-09-04T14:37:51.249425Z",
"structure_string": "Na1 Ac2 Sn1\n1.0\n-0.000000 4.109185 4.109185\n4.109185 -0.000000 4.109185\n4.109185 4.109185 0.000000\nNa Ac Sn\n1 2 1\ndirect\n0.249999 0.249999 0.249999 Na\n0.499999 0.499999 0.499999 Ac\n0.000000 0.000000 0.000000 Ac\n0.749999 0.749999 0.749999 Sn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Ac",
"Sn"
],
"chemical_system": "Ac-Na-Sn",
"density": 7.128193022735338,
"density_atomic": 0.02882457504664201,
"volume": 138.77047600970582,
"volume_molar": 20.89238349656629,
"formula_full": "Na1 Ac2 Sn1",
"formula_reduced": "NaAc2Sn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.219547675,
"spacegroup": 225
},
{
"id": "jvasp-17383",
"created_at": "2022-09-04T14:38:32.761887Z",
"updated_at": "2022-09-04T14:38:32.761918Z",
"structure_string": "Ca1 Ge2 Rh2\n1.0\n3.912190 0.000000 -1.453132\n-0.539747 3.874778 -1.453132\n0.005227 0.006006 6.006927\nCa Ge Rh\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.374214 0.374214 0.748428 Ge\n0.625787 0.625787 0.251573 Ge\n0.750000 0.250001 0.500001 Rh\n0.250000 0.750001 0.500001 Rh\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Ge",
"Rh"
],
"chemical_system": "Ca-Ge-Rh",
"density": 7.12801902760857,
"density_atomic": 0.05486878298005648,
"volume": 91.12649722552409,
"volume_molar": 10.975531865157109,
"formula_full": "Ca1 Ge2 Rh2",
"formula_reduced": "Ca(GeRh)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.3203856639999998,
"spacegroup": 139
},
{
"id": "jvasp-118946",
"created_at": "2022-09-04T14:38:48.047355Z",
"updated_at": "2022-09-04T14:38:48.047369Z",
"structure_string": "Rb1 Te1 Au1\n1.0\n5.995646 0.000000 0.000000\n-2.997823 5.192382 -0.000000\n0.000000 -0.000000 3.068326\nRb Te Au\n1 1 1\ndirect\n0.333334 0.666667 -0.000000 Rb\n0.666668 0.333333 -0.000000 Te\n0.000000 0.000000 0.000000 Au\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Rb",
"Te",
"Au"
],
"chemical_system": "Au-Rb-Te",
"density": 7.127959761423792,
"density_atomic": 0.03140632610951517,
"volume": 95.52215657249671,
"volume_molar": 19.174929085944477,
"formula_full": "Rb1 Te1 Au1",
"formula_reduced": "RbTeAu",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2704875561111112,
"spacegroup": 187
},
{
"id": "jvasp-57011",
"created_at": "2022-09-04T14:37:03.432279Z",
"updated_at": "2022-09-04T14:37:03.432294Z",
"structure_string": "Tm4 B16\n1.0\n7.044177 -0.000000 -0.000000\n-0.000000 7.044177 -0.000000\n0.000000 0.000000 3.984712\nTm B\n4 16\ndirect\n0.180873 0.680874 0.000000 Tm\n0.819127 0.319127 0.000000 Tm\n0.680874 0.819127 0.000000 Tm\n0.319127 0.180873 0.000000 Tm\n0.913203 0.586798 0.500000 B\n0.413203 0.913203 0.500000 B\n0.461430 0.676763 0.500000 B\n0.586798 0.086797 0.500000 B\n0.823238 0.038570 0.500000 B\n0.538570 0.323237 0.500000 B\n0.038570 0.176763 0.500000 B\n0.323237 0.461430 0.500000 B\n0.176763 0.961431 0.500000 B\n0.500000 0.500000 0.202316 B\n0.676763 0.538570 0.500000 B\n0.961431 0.823238 0.500000 B\n0.500000 0.500000 0.797683 B\n0.086797 0.413203 0.500000 B\n0.000000 0.000000 0.202316 B\n0.000000 0.000000 0.797683 B\n",
"nsites": 20,
"nelements": 2,
"elements": [
"Tm",
"B"
],
"chemical_system": "B-Tm",
"density": 7.127749237764496,
"density_atomic": 0.10115154903661931,
"volume": 197.72312130147918,
"volume_molar": 5.9535823399203105,
"formula_full": "Tm4 B16",
"formula_reduced": "TmB4",
"formula_anonymous": "AB4",
"energy_above_hull": 3.981376916666667,
"spacegroup": 127
},
{
"id": "jvasp-15672",
"created_at": "2022-09-04T14:36:55.464605Z",
"updated_at": "2022-09-04T14:36:55.464632Z",
"structure_string": "Nd1 Ni2 B2 C1\n1.0\n3.516167 -0.000000 -1.205108\n-0.413031 3.491824 -1.205108\n-0.035042 -0.039432 5.629905\nNd Ni B C\n1 2 2 1\ndirect\n0.000000 0.000000 0.000000 Nd\n0.250001 0.749999 0.499999 Ni\n0.750001 0.250000 0.499999 Ni\n0.350594 0.350593 0.701185 B\n0.649408 0.649406 0.298813 B\n0.500001 0.499999 -0.000000 C\n",
"nsites": 6,
"nelements": 4,
"elements": [
"Nd",
"Ni",
"B",
"C"
],
"chemical_system": "B-C-Nd-Ni",
"density": 7.127507495771125,
"density_atomic": 0.08722340045482813,
"volume": 68.78887968954298,
"volume_molar": 6.904271936885548,
"formula_full": "Nd1 Ni2 B2 C1",
"formula_reduced": "NdNi2B2C",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 3.3733169111111105,
"spacegroup": 139
},
{
"id": "jvasp-14642",
"created_at": "2022-09-04T14:36:02.540739Z",
"updated_at": "2022-09-04T14:36:02.540765Z",
"structure_string": "V6 As2\n1.0\n4.734399 -0.000000 -0.000000\n-0.000000 4.734399 0.000000\n0.000000 0.000000 4.734399\nV As\n6 2\ndirect\n0.500000 0.250000 0.000000 V\n0.500000 0.750000 0.000000 V\n0.250000 0.000000 0.500000 V\n0.750000 0.000000 0.500000 V\n0.000000 0.500000 0.250000 V\n0.000000 0.500000 0.750000 V\n0.500000 0.500000 0.500000 As\n0.000000 0.000000 0.000000 As\n",
"nsites": 8,
"nelements": 2,
"elements": [
"V",
"As"
],
"chemical_system": "As-V",
"density": 7.127471240208471,
"density_atomic": 0.07538681906951702,
"volume": 106.11934683996812,
"volume_molar": 7.988320550369365,
"formula_full": "V6 As2",
"formula_reduced": "V3As",
"formula_anonymous": "AB3",
"energy_above_hull": 3.7392135875,
"spacegroup": 223
},
{
"id": "jvasp-35436",
"created_at": "2022-09-04T14:37:43.365217Z",
"updated_at": "2022-09-04T14:37:43.365229Z",
"structure_string": "Tb1 Ti2 Ga4\n1.0\n-3.372354 3.372354 -2.732525\n3.372354 -3.372354 -2.732525\n-3.372354 -3.372354 2.732525\nTb Ti Ga\n1 2 4\ndirect\n0.000000 0.000000 0.000000 Tb\n0.750000 0.250000 0.499999 Ti\n0.250000 0.750000 0.499999 Ti\n0.696802 0.696802 0.393604 Ga\n0.303198 0.303198 0.606395 Ga\n0.303199 0.696802 0.000000 Ga\n0.696802 0.303199 0.000000 Ga\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Tb",
"Ti",
"Ga"
],
"chemical_system": "Ga-Tb-Ti",
"density": 7.1274613626090515,
"density_atomic": 0.05631286083588462,
"volume": 124.30552978653401,
"volume_molar": 10.694077108869722,
"formula_full": "Tb1 Ti2 Ga4",
"formula_reduced": "Tb(TiGa2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.1198691952380957,
"spacegroup": 139
},
{
"id": "jvasp-14855",
"created_at": "2022-09-04T14:36:14.442787Z",
"updated_at": "2022-09-04T14:36:14.442797Z",
"structure_string": "Re1 O3\n1.0\n3.792922 -0.000000 0.000000\n0.000000 3.792922 -0.000000\n0.000000 0.000000 3.792922\nRe O\n1 3\ndirect\n0.000000 0.000000 0.000000 Re\n0.500000 0.000000 0.000000 O\n0.000000 0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Re",
"O"
],
"chemical_system": "O-Re",
"density": 7.127281232093695,
"density_atomic": 0.07330578626026615,
"volume": 54.56595180356336,
"volume_molar": 8.215096061610861,
"formula_full": "Re1 O3",
"formula_reduced": "ReO3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.1064671250000004,
"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-87957",
"created_at": "2022-09-04T14:35:52.480567Z",
"updated_at": "2022-09-04T14:35:52.480585Z",
"structure_string": "Tl8 Hg2 I12\n1.0\n9.305157 -0.000000 0.000000\n-0.000000 9.440187 0.000000\n0.000000 0.000000 9.440187\nTl Hg I\n8 2 12\ndirect\n0.250000 0.351978 0.851978 Tl\n0.250000 0.851978 0.648023 Tl\n0.250000 0.648023 0.148022 Tl\n0.750000 0.648023 0.148022 Tl\n0.750000 0.851978 0.648023 Tl\n0.750000 0.148022 0.351978 Tl\n0.750000 0.351978 0.851978 Tl\n0.250000 0.148022 0.351978 Tl\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.500000 Hg\n0.204468 0.500000 0.500000 I\n0.500000 0.358365 0.171488 I\n0.795532 0.500000 0.500000 I\n0.000000 0.328513 0.141635 I\n0.000000 0.858365 0.328513 I\n0.000000 0.141635 0.671488 I\n0.000000 0.671488 0.858365 I\n0.500000 0.828513 0.358365 I\n0.500000 0.171488 0.641636 I\n0.500000 0.641636 0.828513 I\n0.704468 0.000000 0.000000 I\n0.295532 0.000000 0.000000 I\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Tl",
"Hg",
"I"
],
"chemical_system": "Hg-I-Tl",
"density": 7.126961179444861,
"density_atomic": 0.026530032446828958,
"volume": 829.2488915756899,
"volume_molar": 22.69933431883083,
"formula_full": "Tl8 Hg2 I12",
"formula_reduced": "Tl4HgI6",
"formula_anonymous": "AB4C6",
"energy_above_hull": 0.0,
"spacegroup": 128
},
{
"id": "jvasp-50008",
"created_at": "2022-09-04T14:36:10.751453Z",
"updated_at": "2022-09-04T14:36:10.751475Z",
"structure_string": "Re2 O6\n1.0\n2.682125 1.548526 4.379532\n-2.682125 1.548526 4.379532\n0.000000 -3.097051 4.379532\nRe O\n2 6\ndirect\n0.997070 0.997070 0.997067 Re\n0.497070 0.497070 0.497068 Re\n0.247062 0.747557 0.746580 O\n0.247558 0.747061 0.246580 O\n0.246582 0.247557 0.747061 O\n0.747557 0.746582 0.247060 O\n0.746581 0.247062 0.747556 O\n0.747061 0.246582 0.247556 O\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Re",
"O"
],
"chemical_system": "O-Re",
"density": 7.126876774669297,
"density_atomic": 0.07330162631925374,
"volume": 109.1380969524094,
"volume_molar": 8.215562276574206,
"formula_full": "Re2 O6",
"formula_reduced": "ReO3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.1064421250000005,
"spacegroup": 221
}
]
}