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_atomic&page=1588",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density_atomic&page=1586",
"results": [
{
"id": "jvasp-8090",
"created_at": "2022-09-04T14:37:07.904019Z",
"updated_at": "2022-09-04T14:37:07.904045Z",
"structure_string": "Al1 Tl1 F4\n1.0\n3.674717 -0.000000 -0.000000\n0.000000 3.674717 -0.000000\n0.000000 0.000000 6.360422\nAl Tl F\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.718014 F\n0.000000 0.000000 0.281986 F\n0.500000 0.000000 0.000000 F\n0.000000 0.500000 0.000000 F\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Al",
"Tl",
"F"
],
"chemical_system": "Al-F-Tl",
"density": 5.942381482689224,
"density_atomic": 0.06985822108564706,
"volume": 85.88824488736873,
"volume_molar": 8.62051833901808,
"formula_full": "Al1 Tl1 F4",
"formula_reduced": "AlTlF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0010883333333331,
"spacegroup": 123
},
{
"id": "jvasp-88839",
"created_at": "2022-09-04T14:38:12.052681Z",
"updated_at": "2022-09-04T14:38:12.052706Z",
"structure_string": "Sr4 Cd2 W2 O12\n1.0\n5.813143 0.000000 0.000000\n0.000000 5.956277 0.000000\n0.000000 0.000000 8.268612\nSr Cd W O\n4 2 2 12\ndirect\n0.000000 0.511715 0.256893 Sr\n0.000000 0.511715 0.743107 Sr\n0.500000 0.950287 0.243107 Sr\n0.500000 0.950287 0.756893 Sr\n0.500000 0.464848 0.000000 Cd\n0.000000 -0.002849 0.500000 Cd\n0.000000 0.974363 0.000000 W\n0.500000 0.487636 0.500000 W\n0.232474 0.736877 0.000000 O\n0.767526 0.736877 0.000000 O\n0.500000 0.506072 0.732624 O\n0.261182 0.269161 0.500000 O\n0.738818 0.269161 0.500000 O\n0.267526 0.725123 0.500000 O\n0.732473 0.725123 0.500000 O\n0.000000 0.955930 0.232627 O\n0.000000 0.955930 0.767373 O\n0.500000 0.506072 0.267376 O\n0.238821 0.192838 0.000000 O\n0.761179 0.192838 0.000000 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Sr",
"Cd",
"W",
"O"
],
"chemical_system": "Cd-O-Sr-W",
"density": 6.582893210083024,
"density_atomic": 0.06985725063299739,
"volume": 286.2981268053643,
"volume_molar": 8.620638094731163,
"formula_full": "Sr4 Cd2 W2 O12",
"formula_reduced": "Sr2CdWO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.062871337,
"spacegroup": 59
},
{
"id": "jvasp-70228",
"created_at": "2022-09-04T14:35:45.094215Z",
"updated_at": "2022-09-04T14:35:45.094238Z",
"structure_string": "La1 Be2 Co1\n1.0\n2.882563 0.000000 0.000000\n0.000000 2.882563 0.000000\n-0.000000 0.000000 6.891140\nLa Be Co\n1 2 1\ndirect\n0.499999 0.499999 0.500000 La\n0.000000 0.000000 0.847172 Be\n0.000000 0.000000 0.152828 Be\n0.499999 0.499999 0.000000 Co\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Be",
"Co"
],
"chemical_system": "Be-Co-La",
"density": 6.260062591388424,
"density_atomic": 0.06985722062628782,
"volume": 57.259649956568246,
"volume_molar": 8.620641797669547,
"formula_full": "La1 Be2 Co1",
"formula_reduced": "LaBe2Co",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.228312025,
"spacegroup": 123
},
{
"id": "jvasp-114621",
"created_at": "2022-09-04T14:38:41.467466Z",
"updated_at": "2022-09-04T14:38:41.467482Z",
"structure_string": "Ag1 Cl1 O3\n1.0\n2.690224 1.553201 2.854911\n-2.690224 1.553201 2.854911\n-0.000000 -3.106403 2.854911\nAg Cl O\n1 1 3\ndirect\n-0.015572 -0.015572 -0.015572 Ag\n0.495176 0.495176 0.495176 Cl\n0.125245 0.577575 0.577576 O\n0.577576 0.577576 0.125244 O\n0.577575 0.125245 0.577576 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ag",
"Cl",
"O"
],
"chemical_system": "Ag-Cl-O",
"density": 4.438621227882772,
"density_atomic": 0.06985700829051159,
"volume": 71.57478000212515,
"volume_molar": 8.620668000776616,
"formula_full": "Ag1 Cl1 O3",
"formula_reduced": "AgClO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.5109183654999998,
"spacegroup": 160
},
{
"id": "jvasp-44224",
"created_at": "2022-09-04T14:38:08.066788Z",
"updated_at": "2022-09-04T14:38:08.066810Z",
"structure_string": "Cr4 O12\n1.0\n5.101324 0.000000 0.000000\n0.000000 5.654633 0.000000\n0.000000 0.000000 7.940245\nCr O\n4 12\ndirect\n0.561032 0.262295 0.311287 Cr\n0.061032 0.237705 0.811288 Cr\n0.938967 0.762295 0.311287 Cr\n0.438967 0.737705 0.811288 Cr\n0.879894 0.202454 0.649961 O\n0.311101 0.028451 0.811287 O\n0.379895 0.297546 0.472614 O\n0.879894 0.202453 0.972614 O\n0.811101 0.471548 0.311287 O\n0.379895 0.297546 0.149960 O\n0.620105 0.702453 0.649961 O\n0.188899 0.528451 0.811287 O\n0.120105 0.797546 0.472614 O\n0.620105 0.702453 0.972614 O\n0.688898 0.971548 0.311287 O\n0.120105 0.797546 0.149960 O\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Cr",
"O"
],
"chemical_system": "Cr-O",
"density": 2.899766973568378,
"density_atomic": 0.0698552013147259,
"volume": 229.0452206688738,
"volume_molar": 8.620890995457621,
"formula_full": "Cr4 O12",
"formula_reduced": "CrO3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.5788144750000006,
"spacegroup": 62
},
{
"id": "jvasp-51436",
"created_at": "2022-09-04T14:37:13.668054Z",
"updated_at": "2022-09-04T14:37:13.668082Z",
"structure_string": "Ti2 Zn2 O6\n1.0\n5.521779 -0.064338 -0.066075\n2.036437 5.149339 -0.022077\n2.469572 1.540398 4.982818\nTi Zn O\n2 2 6\ndirect\n0.245465 0.095866 0.918409 Ti\n0.754534 0.904131 0.081594 Ti\n0.553940 0.413860 0.259165 Zn\n0.446059 0.586141 0.740836 Zn\n0.289137 0.358944 0.608702 O\n0.105436 0.853689 0.843900 O\n0.548564 0.773225 0.956920 O\n0.710865 0.641057 0.391297 O\n0.894565 0.146310 0.156101 O\n0.451436 0.226774 0.043081 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ti",
"Zn",
"O"
],
"chemical_system": "O-Ti-Zn",
"density": 3.74139897469829,
"density_atomic": 0.06985379953129232,
"volume": 143.15613563039346,
"volume_molar": 8.621063994238808,
"formula_full": "Ti2 Zn2 O6",
"formula_reduced": "TiZnO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.5300338466666663,
"spacegroup": 2
},
{
"id": "jvasp-39096",
"created_at": "2022-09-04T14:37:42.689966Z",
"updated_at": "2022-09-04T14:37:42.689988Z",
"structure_string": "Si1 Tc2 W1\n1.0\n0.000000 3.059258 3.059258\n3.059258 -0.000000 3.059258\n3.059258 3.059258 0.000000\nSi Tc W\n1 2 1\ndirect\n0.250000 0.250000 0.250000 Si\n0.000000 0.000000 0.000000 Tc\n0.500000 0.500000 0.500000 Tc\n0.750001 0.750001 0.750001 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Si",
"Tc",
"W"
],
"chemical_system": "Si-Tc-W",
"density": 11.829098363695104,
"density_atomic": 0.06985245632810444,
"volume": 57.26355536033799,
"volume_molar": 8.621229769950197,
"formula_full": "Si1 Tc2 W1",
"formula_reduced": "SiTc2W",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.427452899999999,
"spacegroup": 225
},
{
"id": "jvasp-123564",
"created_at": "2022-09-04T14:38:51.946995Z",
"updated_at": "2022-09-04T14:38:51.947008Z",
"structure_string": "Co1 P3\n1.0\n3.067861 -0.000000 -0.982367\n-0.211194 3.443156 -0.659542\n0.089068 -0.791320 5.559685\nCo P\n1 3\ndirect\n0.369487 0.854328 0.738973 Co\n0.588178 0.114670 0.176354 P\n0.143118 0.576285 0.286233 P\n0.899221 0.454720 0.798442 P\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Co",
"P"
],
"chemical_system": "Co-P",
"density": 4.403501330024443,
"density_atomic": 0.06985241312811476,
"volume": 57.26359077479098,
"volume_molar": 8.621235101720718,
"formula_full": "Co1 P3",
"formula_reduced": "CoP3",
"formula_anonymous": "AB3",
"energy_above_hull": 3.03259435,
"spacegroup": 8
},
{
"id": "jvasp-71918",
"created_at": "2022-09-04T14:36:18.293820Z",
"updated_at": "2022-09-04T14:36:18.293847Z",
"structure_string": "Ta1 Be1 Ga2\n1.0\n-1.821238 1.821238 4.316056\n1.821238 -1.821238 4.316056\n1.821238 1.821238 -4.316056\nTa Be Ga\n1 1 2\ndirect\n0.250000 0.750001 0.500001 Ta\n0.750001 0.250000 0.500001 Be\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.000000 Ga\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ta",
"Be",
"Ga"
],
"chemical_system": "Be-Ga-Ta",
"density": 9.552129812485735,
"density_atomic": 0.06985210892501505,
"volume": 57.26384015540499,
"volume_molar": 8.621272646849729,
"formula_full": "Ta1 Be1 Ga2",
"formula_reduced": "TaBeGa2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.9007124874999997,
"spacegroup": 139
},
{
"id": "jvasp-71897",
"created_at": "2022-09-04T14:35:49.342706Z",
"updated_at": "2022-09-04T14:35:49.342731Z",
"structure_string": "Ti1 Be1 Ge2\n1.0\n-1.819843 1.819843 4.323035\n1.819843 -1.819843 4.323035\n1.819843 1.819843 -4.323035\nTi Be Ge\n1 1 2\ndirect\n0.499999 0.499999 0.000000 Ti\n0.749999 0.250000 0.499999 Be\n0.000000 0.000000 0.000000 Ge\n0.250000 0.749999 0.499999 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Be",
"Ge"
],
"chemical_system": "Be-Ge-Ti",
"density": 5.861732304903054,
"density_atomic": 0.06984629973377003,
"volume": 57.26860285006676,
"volume_molar": 8.62198968729098,
"formula_full": "Ti1 Be1 Ge2",
"formula_reduced": "TiBeGe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.7778040833333335,
"spacegroup": 119
},
{
"id": "jvasp-8289",
"created_at": "2022-09-04T14:36:42.760718Z",
"updated_at": "2022-09-04T14:36:42.760739Z",
"structure_string": "Ca1 Mn2 N2\n1.0\n3.257049 0.000000 0.000000\n0.000000 3.257019 0.000000\n0.000000 0.000000 6.748624\nCa Mn N\n1 2 2\ndirect\n0.000000 0.000000 0.250000 Ca\n0.500000 0.500000 0.896906 Mn\n0.500000 0.500000 0.603095 Mn\n0.500000 0.000000 0.494089 N\n0.000000 0.500000 0.005909 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"Mn",
"N"
],
"chemical_system": "Ca-Mn-N",
"density": 4.127907495577186,
"density_atomic": 0.06984095800647516,
"volume": 71.591228739108,
"volume_molar": 8.622649132965316,
"formula_full": "Ca1 Mn2 N2",
"formula_reduced": "Ca(MnN)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.8508622805517234,
"spacegroup": 115
},
{
"id": "jvasp-90017",
"created_at": "2022-09-04T14:35:56.573785Z",
"updated_at": "2022-09-04T14:35:56.573804Z",
"structure_string": "Co1 Cl2 O6\n1.0\n-3.560388 -2.524199 0.540909\n-3.560388 2.524199 0.540909\n-5.841081 0.000000 -6.282007\nCo Cl O\n1 2 6\ndirect\n0.000000 0.000000 0.000000 Co\n0.348567 0.348567 0.241716 Cl\n0.651433 0.651433 0.758285 Cl\n0.737816 0.234788 0.844267 O\n0.765212 0.262184 0.155733 O\n0.262184 0.765212 0.155733 O\n0.234788 0.737816 0.844267 O\n0.605641 0.605641 0.437857 O\n0.394359 0.394359 0.562143 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Co",
"Cl",
"O"
],
"chemical_system": "Cl-Co-O",
"density": 2.9100956038602894,
"density_atomic": 0.06984065032708468,
"volume": 128.86477943504684,
"volume_molar": 8.622687119602281,
"formula_full": "Co1 Cl2 O6",
"formula_reduced": "Co(ClO3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 2.369988892777778,
"spacegroup": 12
}
]
}