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=spacegroup&page=4570",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=spacegroup&page=4568",
"results": [
{
"id": "jvasp-103251",
"created_at": "2022-09-04T14:36:40.914488Z",
"updated_at": "2022-09-04T14:36:40.914517Z",
"structure_string": "Er2 Mg4\n1.0\n5.170113 0.000000 2.984966\n1.723371 4.874430 2.984966\n0.000000 0.000000 5.969933\nEr Mg\n2 4\ndirect\n0.749999 0.750000 0.750001 Er\n0.500000 0.500000 0.500001 Er\n0.125000 0.625000 0.125001 Mg\n0.125000 0.125000 0.125000 Mg\n0.625000 0.125000 0.125001 Mg\n0.125000 0.125000 0.625000 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Er",
"Mg"
],
"chemical_system": "Er-Mg",
"density": 4.765144143402462,
"density_atomic": 0.039880254390175666,
"volume": 150.4503943555103,
"volume_molar": 15.100557536773207,
"formula_full": "Er2 Mg4",
"formula_reduced": "ErMg2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.372058888888889,
"spacegroup": 227
},
{
"id": "jvasp-12468",
"created_at": "2022-09-04T14:36:41.980849Z",
"updated_at": "2022-09-04T14:36:41.980875Z",
"structure_string": "Li4 Zn2 Cl8\n1.0\n6.313980 0.000000 3.645378\n2.104660 5.952877 3.645378\n0.000000 0.000000 7.290756\nLi Zn Cl\n4 2 8\ndirect\n0.500000 -0.000000 0.500000 Li\n-0.000000 0.500000 0.500000 Li\n0.500000 0.500000 0.500000 Li\n0.500000 0.500000 0.000000 Li\n0.875000 0.875000 0.875001 Zn\n0.125000 0.125000 0.125000 Zn\n0.254035 0.254036 0.737894 Cl\n0.745965 0.745965 0.745965 Cl\n0.254035 0.254036 0.254036 Cl\n0.745965 0.745965 0.262107 Cl\n0.262106 0.745965 0.745965 Cl\n0.745965 0.262106 0.745965 Cl\n0.737894 0.254036 0.254036 Cl\n0.254035 0.737894 0.254036 Cl\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Li",
"Zn",
"Cl"
],
"chemical_system": "Cl-Li-Zn",
"density": 2.679606690292994,
"density_atomic": 0.05108875986834693,
"volume": 274.0328799539717,
"volume_molar": 11.787604113935716,
"formula_full": "Li4 Zn2 Cl8",
"formula_reduced": "Li2ZnCl4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.0,
"spacegroup": 227
},
{
"id": "jvasp-12403",
"created_at": "2022-09-04T14:36:42.310747Z",
"updated_at": "2022-09-04T14:36:42.310761Z",
"structure_string": "Zn2 In4 S8\n1.0\n6.564241 0.000000 3.789866\n2.188080 6.188825 3.789866\n0.000000 0.000000 7.579732\nZn In S\n2 4 8\ndirect\n0.125000 0.125000 0.125000 Zn\n0.875000 0.875001 0.875001 Zn\n0.500000 0.500000 0.000000 In\n0.500000 0.500000 0.500000 In\n-0.000000 0.500000 0.500000 In\n0.500000 -0.000000 0.500000 In\n0.745934 0.745935 0.745935 S\n0.254065 0.254066 0.737805 S\n0.254065 0.737806 0.254066 S\n0.737805 0.254066 0.254066 S\n0.745934 0.262195 0.745935 S\n0.262195 0.745935 0.745935 S\n0.254065 0.254066 0.254065 S\n0.745934 0.745935 0.262196 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Zn",
"In",
"S"
],
"chemical_system": "In-S-Zn",
"density": 4.56547449846844,
"density_atomic": 0.04546544702478843,
"volume": 307.92614867213325,
"volume_molar": 13.245532935630525,
"formula_full": "Zn2 In4 S8",
"formula_reduced": "Zn(InS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.7616857100000001,
"spacegroup": 227
},
{
"id": "jvasp-59882",
"created_at": "2022-09-04T14:36:42.483922Z",
"updated_at": "2022-09-04T14:36:42.483944Z",
"structure_string": "Y2 Co4 S8\n1.0\n6.343616 0.000000 -3.330479\n-1.748544 6.097874 -3.330479\n-0.291561 -0.386915 7.151294\nY Co S\n2 4 8\ndirect\n0.375002 0.625001 0.750000 Y\n0.625000 0.375000 0.250000 Y\n0.000000 0.500001 0.000001 Co\n0.000001 0.000000 0.500000 Co\n0.500001 0.000000 0.500000 Co\n0.000000 0.000000 0.000000 Co\n0.771527 0.814326 0.543053 S\n0.771274 0.228475 0.956949 S\n0.185676 0.228475 0.956948 S\n0.228474 0.185674 0.456948 S\n0.228473 0.771272 0.456946 S\n0.228727 0.771526 0.043053 S\n0.771527 0.228727 0.543052 S\n0.814326 0.771526 0.043052 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Y",
"Co",
"S"
],
"chemical_system": "Co-S-Y",
"density": 4.274864635493882,
"density_atomic": 0.05378791486350909,
"volume": 260.2815155695487,
"volume_molar": 11.196085171328239,
"formula_full": "Y2 Co4 S8",
"formula_reduced": "Y(CoS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.6668681785714288,
"spacegroup": 227
},
{
"id": "jvasp-50009",
"created_at": "2022-09-04T14:36:42.871840Z",
"updated_at": "2022-09-04T14:36:42.871867Z",
"structure_string": "La4 Pt4 O14\n1.0\n-5.298778 5.298778 -0.000000\n5.298778 -0.000000 5.298778\n5.298778 5.298778 0.000000\nLa Pt O\n4 4 14\ndirect\n0.625000 0.750000 0.125000 La\n0.125000 0.250000 0.125000 La\n0.125000 0.750000 0.125000 La\n0.125000 0.250000 0.625000 La\n0.625000 0.250000 0.125000 Pt\n0.625000 0.250000 0.625000 Pt\n0.625000 0.750000 0.625000 Pt\n0.125000 0.750000 0.625000 Pt\n0.957427 0.914853 0.542574 O\n0.542574 0.085147 0.957427 O\n0.957427 0.500000 0.957427 O\n0.250000 0.500000 0.250000 O\n0.542574 0.500000 0.542574 O\n0.292574 0.000000 0.707427 O\n0.292574 0.000000 0.292574 O\n0.707427 0.000000 0.707427 O\n0.000000 0.000000 0.000000 O\n0.542574 0.500000 0.957427 O\n0.707427 0.414853 0.292574 O\n0.707427 0.000000 0.292574 O\n0.957427 0.500000 0.542574 O\n0.292574 0.585147 0.707427 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"La",
"Pt",
"O"
],
"chemical_system": "La-O-Pt",
"density": 8.705675238947284,
"density_atomic": 0.07393762763355034,
"volume": 297.5480916027817,
"volume_molar": 8.14489313864239,
"formula_full": "La4 Pt4 O14",
"formula_reduced": "La2Pt2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 2.653807027272727,
"spacegroup": 227
},
{
"id": "jvasp-7657",
"created_at": "2022-09-04T14:36:43.160672Z",
"updated_at": "2022-09-04T14:36:43.160703Z",
"structure_string": "Hf2 V4\n1.0\n4.462448 -0.000000 2.576396\n1.487483 4.207237 2.576396\n-0.000000 -0.000000 5.152791\nHf V\n2 4\ndirect\n0.125000 0.125000 0.125000 Hf\n0.874999 0.875001 0.875001 Hf\n0.500000 0.000000 0.500000 V\n-0.000000 0.500000 0.500000 V\n0.500000 0.500000 0.500001 V\n0.500000 0.500000 0.000001 V\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Hf",
"V"
],
"chemical_system": "Hf-V",
"density": 9.625041452660978,
"density_atomic": 0.062020973277159566,
"volume": 96.74146797386067,
"volume_molar": 9.709845624460348,
"formula_full": "Hf2 V4",
"formula_reduced": "HfV2",
"formula_anonymous": "AB2",
"energy_above_hull": 4.208320466666667,
"spacegroup": 227
},
{
"id": "jvasp-15028",
"created_at": "2022-09-04T14:36:43.640288Z",
"updated_at": "2022-09-04T14:36:43.640312Z",
"structure_string": "Nd2 Pt4\n1.0\n4.777704 -0.000000 2.758408\n1.592568 4.504461 2.758408\n-0.000000 0.000000 5.516816\nNd Pt\n2 4\ndirect\n0.875000 0.875000 0.875001 Nd\n0.125000 0.125000 0.125000 Nd\n0.500000 0.500000 0.500001 Pt\n0.500000 0.500000 0.000000 Pt\n0.000000 0.500000 0.500000 Pt\n0.500000 0.000000 0.500001 Pt\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Nd",
"Pt"
],
"chemical_system": "Nd-Pt",
"density": 14.948688736160506,
"density_atomic": 0.05053597861811819,
"volume": 118.72729417866415,
"volume_molar": 11.916541293297401,
"formula_full": "Nd2 Pt4",
"formula_reduced": "NdPt2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.6779181000000003,
"spacegroup": 227
},
{
"id": "jvasp-15032",
"created_at": "2022-09-04T14:36:43.893598Z",
"updated_at": "2022-09-04T14:36:43.893620Z",
"structure_string": "Tb2 Ir4\n1.0\n4.647542 0.000000 2.683259\n1.549180 4.381744 2.683259\n-0.000000 0.000000 5.366519\nTb Ir\n2 4\ndirect\n0.125000 0.125000 0.125000 Tb\n0.875000 0.874999 0.875001 Tb\n0.000000 0.499999 0.500000 Ir\n0.500000 -0.000000 0.500000 Ir\n0.500000 0.499999 0.000000 Ir\n0.500000 0.499999 0.500000 Ir\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Tb",
"Ir"
],
"chemical_system": "Ir-Tb",
"density": 16.5121354566005,
"density_atomic": 0.054902011349689035,
"volume": 109.28561363233159,
"volume_molar": 10.968889138947928,
"formula_full": "Tb2 Ir4",
"formula_reduced": "TbIr2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.8702201999999986,
"spacegroup": 227
},
{
"id": "jvasp-14988",
"created_at": "2022-09-04T14:36:44.219301Z",
"updated_at": "2022-09-04T14:36:44.219319Z",
"structure_string": "Dy2 Co4\n1.0\n4.329315 0.000000 2.499531\n1.443105 4.081718 2.499531\n-0.000000 -0.000000 4.999062\nDy Co\n2 4\ndirect\n0.125000 0.125000 0.125000 Dy\n0.874998 0.875001 0.875000 Dy\n0.499999 0.000000 0.500000 Co\n-0.000001 0.500000 0.500000 Co\n0.499999 0.500000 0.500000 Co\n0.499999 0.500000 0.000000 Co\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Dy",
"Co"
],
"chemical_system": "Co-Dy",
"density": 10.540333127995265,
"density_atomic": 0.06792044842751761,
"volume": 88.33863937755056,
"volume_molar": 8.866462014641472,
"formula_full": "Dy2 Co4",
"formula_reduced": "DyCo2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.275949433333333,
"spacegroup": 227
},
{
"id": "jvasp-7793",
"created_at": "2022-09-04T14:36:44.283505Z",
"updated_at": "2022-09-04T14:36:44.283528Z",
"structure_string": "Al2 Tl2 O4\n1.0\n4.881412 -0.077639 2.946556\n1.625310 4.603540 2.946556\n-0.111619 -0.077639 5.700694\nAl Tl O\n2 2 4\ndirect\n0.375000 0.375000 0.375000 Al\n0.625000 0.625000 0.625001 Al\n0.875003 0.875003 0.875005 Tl\n0.124996 0.124996 0.124997 Tl\n0.500000 -0.000000 0.500000 O\n-0.000000 0.500000 0.500000 O\n0.500000 0.500000 0.500001 O\n0.500000 0.500000 0.000001 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Al",
"Tl",
"O"
],
"chemical_system": "Al-O-Tl",
"density": 6.671198308213665,
"density_atomic": 0.06101813519494735,
"volume": 131.1085626337274,
"volume_molar": 9.869427737769783,
"formula_full": "Al2 Tl2 O4",
"formula_reduced": "AlTlO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8916831000000001,
"spacegroup": 227
},
{
"id": "jvasp-57772",
"created_at": "2022-09-04T14:36:44.572650Z",
"updated_at": "2022-09-04T14:36:44.572679Z",
"structure_string": "K2 Os4 O12\n1.0\n6.247397 0.000000 3.606936\n2.082465 5.890102 3.606936\n0.000000 0.000000 7.213872\nK Os O\n2 4 12\ndirect\n0.625001 0.625000 0.625000 K\n0.375001 0.375000 0.375000 K\n0.000000 0.500000 0.000000 Os\n0.000000 0.000000 0.000000 Os\n-0.000000 -0.000000 0.500000 Os\n0.500000 -0.000000 0.000000 Os\n0.066444 0.683557 0.066443 O\n0.683557 0.066443 0.683557 O\n0.683557 0.066443 0.066443 O\n0.316444 0.933557 0.933557 O\n0.933558 0.316443 0.316443 O\n0.316444 0.933557 0.316443 O\n0.316443 0.316443 0.933557 O\n0.933558 0.933557 0.316444 O\n0.933558 0.316443 0.933557 O\n0.066444 0.683557 0.683557 O\n0.683558 0.683557 0.066443 O\n0.066443 0.066443 0.683557 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"K",
"Os",
"O"
],
"chemical_system": "K-O-Os",
"density": 6.450056087353027,
"density_atomic": 0.06780819011682433,
"volume": 265.4546592231475,
"volume_molar": 8.881140684664592,
"formula_full": "K2 Os4 O12",
"formula_reduced": "K(OsO3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 3.202553222222223,
"spacegroup": 227
},
{
"id": "jvasp-100592",
"created_at": "2022-09-04T14:36:44.616329Z",
"updated_at": "2022-09-04T14:36:44.616357Z",
"structure_string": "Rb2 Co2 O4\n1.0\n5.063070 0.000000 2.923165\n1.687690 4.773508 2.923165\n0.000000 0.000000 5.846329\nRb Co O\n2 2 4\ndirect\n0.500000 0.500000 0.499999 Rb\n0.750000 0.750000 0.749999 Rb\n0.000000 0.000000 0.000000 Co\n0.250000 0.250000 0.250000 Co\n0.125000 0.125000 0.125000 O\n0.625000 0.125000 0.124999 O\n0.125000 0.125000 0.625000 O\n0.125000 0.625000 0.124999 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Rb",
"Co",
"O"
],
"chemical_system": "Co-O-Rb",
"density": 4.146124425779533,
"density_atomic": 0.0566180814646573,
"volume": 141.29761717542195,
"volume_molar": 10.636426746037307,
"formula_full": "Rb2 Co2 O4",
"formula_reduced": "RbCoO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.480879475,
"spacegroup": 227
}
]
}