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=99",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=97",
"results": [
{
"id": "jvasp-111247",
"created_at": "2022-09-04T14:38:49.140674Z",
"updated_at": "2022-09-04T14:38:49.140702Z",
"structure_string": "Ac1 Sn1 Hg2\n1.0\n4.716434 0.000000 2.723034\n1.572145 4.446696 2.723034\n0.000000 0.000000 5.446068\nAc Sn Hg\n1 1 2\ndirect\n0.499999 0.500000 0.500000 Ac\n0.000000 0.000000 0.000000 Sn\n0.250000 0.250000 0.250000 Hg\n0.749999 0.750001 0.750000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ac",
"Sn",
"Hg"
],
"chemical_system": "Ac-Hg-Sn",
"density": 10.85854114581255,
"density_atomic": 0.03502077320672807,
"volume": 114.21792364171827,
"volume_molar": 17.19591033713398,
"formula_full": "Ac1 Sn1 Hg2",
"formula_reduced": "AcSnHg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-111211",
"created_at": "2022-09-04T14:38:49.125647Z",
"updated_at": "2022-09-04T14:38:49.125669Z",
"structure_string": "K2 Y1 Cu1 I6\n1.0\n7.149476 -0.000000 4.127752\n2.383159 6.740591 4.127752\n-0.000000 -0.000000 8.255504\nK Y Cu I\n2 1 1 6\ndirect\n0.750001 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.499999 Y\n0.000000 0.000000 0.000000 Cu\n0.756624 0.243376 0.243376 I\n0.243377 0.243376 0.756623 I\n0.243377 0.756623 0.756623 I\n0.243377 0.756623 0.243376 I\n0.756624 0.243376 0.756623 I\n0.756624 0.756623 0.243376 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Y",
"Cu",
"I"
],
"chemical_system": "Cu-I-K-Y",
"density": 4.140739796699674,
"density_atomic": 0.02513530844779208,
"volume": 397.84671911907304,
"volume_molar": 23.958889434392407,
"formula_full": "K2 Y1 Cu1 I6",
"formula_reduced": "K2YCuI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-119622",
"created_at": "2022-09-04T14:38:51.622308Z",
"updated_at": "2022-09-04T14:38:51.622326Z",
"structure_string": "Mg7 V1 H16\n1.0\n5.663869 -0.000000 3.270036\n1.887956 5.339947 3.270036\n-0.000000 -0.000000 6.540072\nMg V H\n7 1 16\ndirect\n0.000000 0.000000 0.500000 Mg\n0.500000 0.000000 0.500000 Mg\n0.000000 0.500000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n0.000000 0.500000 0.000000 Mg\n0.500000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 V\n0.372087 0.883739 0.372087 H\n0.372087 0.372087 0.883739 H\n0.627914 0.627914 0.627913 H\n0.116262 0.627914 0.627913 H\n0.627913 0.116261 0.627913 H\n0.627914 0.627914 0.116261 H\n0.116955 0.116955 0.116955 H\n0.883045 0.883045 0.883045 H\n0.116955 0.649135 0.116955 H\n0.116955 0.116955 0.649134 H\n0.883739 0.372087 0.372087 H\n0.350866 0.883045 0.883045 H\n0.883045 0.350866 0.883045 H\n0.883045 0.883045 0.350866 H\n0.649135 0.116955 0.116955 H\n0.372087 0.372087 0.372087 H\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Mg",
"V",
"H"
],
"chemical_system": "H-Mg-V",
"density": 1.9913040979150605,
"density_atomic": 0.12133289657737958,
"volume": 197.80290982086703,
"volume_molar": 4.9633206903285325,
"formula_full": "Mg7 V1 H16",
"formula_reduced": "Mg7VH16",
"formula_anonymous": "AB7C16",
"energy_above_hull": 2.093995314583333,
"spacegroup": 225
},
{
"id": "jvasp-106410",
"created_at": "2022-09-04T14:38:48.519191Z",
"updated_at": "2022-09-04T14:38:48.519211Z",
"structure_string": "K3 Gd1 Cl6\n1.0\n6.783862 -0.000000 3.916665\n2.261287 6.395886 3.916665\n-0.000000 -0.000000 7.833329\nK Gd Cl\n3 1 6\ndirect\n0.750000 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.499999 K\n0.000000 0.000000 0.000000 Gd\n0.761529 0.238471 0.238470 Cl\n0.238470 0.238471 0.761529 Cl\n0.238470 0.761530 0.761529 Cl\n0.238470 0.761530 0.238470 Cl\n0.761529 0.238471 0.761529 Cl\n0.761530 0.761530 0.238469 Cl\n",
"nsites": 10,
"nelements": 3,
"elements": [
"K",
"Gd",
"Cl"
],
"chemical_system": "Cl-Gd-K",
"density": 2.3806105656115,
"density_atomic": 0.029422252188315616,
"volume": 339.87880791706607,
"volume_molar": 20.46798022617574,
"formula_full": "K3 Gd1 Cl6",
"formula_reduced": "K3GdCl6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.3004361905000007,
"spacegroup": 225
},
{
"id": "jvasp-111236",
"created_at": "2022-09-04T14:38:48.499205Z",
"updated_at": "2022-09-04T14:38:48.499228Z",
"structure_string": "Rb2 Li1 Ga1 F6\n1.0\n5.015136 -0.000000 2.895490\n1.671712 4.728315 2.895490\n-0.000000 -0.000000 5.790980\nRb Li Ga F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750001 0.750000 Rb\n0.500000 0.500001 0.500000 Li\n0.000000 0.000000 0.000000 Ga\n0.236885 0.236885 0.763115 F\n0.236884 0.763116 0.763115 F\n0.763116 0.763116 0.236884 F\n0.236884 0.763116 0.236884 F\n0.763116 0.236885 0.763115 F\n0.763116 0.236885 0.236884 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Li",
"Ga",
"F"
],
"chemical_system": "F-Ga-Li-Rb",
"density": 4.372444952676534,
"density_atomic": 0.07282136558339279,
"volume": 137.32233555203393,
"volume_molar": 8.269744341863007,
"formula_full": "Rb2 Li1 Ga1 F6",
"formula_reduced": "Rb2LiGaF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-110718",
"created_at": "2022-09-04T14:38:48.481966Z",
"updated_at": "2022-09-04T14:38:48.481988Z",
"structure_string": "Rb2 In1 As1 I6\n1.0\n7.362709 0.000000 4.250862\n2.454236 6.941629 4.250862\n-0.000000 0.000000 8.501724\nRb In As I\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.499999 In\n0.000000 0.000000 0.000000 As\n0.759263 0.240737 0.240737 I\n0.240737 0.240737 0.759262 I\n0.240738 0.759263 0.759262 I\n0.240738 0.759263 0.240737 I\n0.759263 0.240737 0.759262 I\n0.759263 0.759263 0.240737 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"In",
"As",
"I"
],
"chemical_system": "As-I-In-Rb",
"density": 4.288203677691847,
"density_atomic": 0.023014098275604435,
"volume": 434.51626391116395,
"volume_molar": 26.167181037823376,
"formula_full": "Rb2 In1 As1 I6",
"formula_reduced": "Rb2InAsI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-117148",
"created_at": "2022-09-04T14:38:48.420679Z",
"updated_at": "2022-09-04T14:38:48.420705Z",
"structure_string": "Mg6 V1 H16\n1.0\n5.721330 -0.000000 3.303211\n1.907110 5.394121 3.303211\n-0.000000 -0.000000 6.606422\nMg V H\n6 1 16\ndirect\n0.000000 0.000000 0.500000 Mg\n0.500000 0.000000 0.500000 Mg\n0.000000 0.500000 0.500000 Mg\n0.500000 0.500000 -0.000000 Mg\n0.000000 0.500000 -0.000000 Mg\n0.500000 0.000000 -0.000000 Mg\n0.000000 0.000000 0.000000 V\n0.357337 0.927992 0.357336 H\n0.357336 0.357336 0.927991 H\n0.642664 0.642663 0.642663 H\n0.072008 0.642663 0.642663 H\n0.642664 0.072008 0.642663 H\n0.642664 0.642663 0.072008 H\n0.110237 0.110237 0.110237 H\n0.110237 0.110237 0.669290 H\n0.110237 0.669290 0.110237 H\n0.927992 0.357336 0.357336 H\n0.889763 0.889763 0.889762 H\n0.330710 0.889763 0.889763 H\n0.889763 0.330710 0.889763 H\n0.889763 0.889763 0.330709 H\n0.669290 0.110237 0.110237 H\n0.357336 0.357336 0.357336 H\n",
"nsites": 23,
"nelements": 3,
"elements": [
"Mg",
"V",
"H"
],
"chemical_system": "H-Mg-V",
"density": 1.7339548567873326,
"density_atomic": 0.11280902401742787,
"volume": 203.8843984364826,
"volume_molar": 5.338350200662705,
"formula_full": "Mg6 V1 H16",
"formula_reduced": "Mg6VH16",
"formula_anonymous": "AB6C16",
"energy_above_hull": 2.2295395,
"spacegroup": 225
},
{
"id": "jvasp-110823",
"created_at": "2022-09-04T14:38:48.363633Z",
"updated_at": "2022-09-04T14:38:48.363657Z",
"structure_string": "Mg1 Al1 Ni2\n1.0\n3.602581 -0.000000 2.079951\n1.200860 3.396546 2.079951\n-0.000000 -0.000000 4.159902\nMg Al Ni\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500001 0.499999 Al\n0.250000 0.250000 0.250000 Ni\n0.750000 0.750001 0.749999 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Al",
"Ni"
],
"chemical_system": "Al-Mg-Ni",
"density": 5.502514354194646,
"density_atomic": 0.0785824630291205,
"volume": 50.901942313995804,
"volume_molar": 7.663466539307072,
"formula_full": "Mg1 Al1 Ni2",
"formula_reduced": "MgAlNi2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.6087666625000001,
"spacegroup": 225
},
{
"id": "jvasp-113667",
"created_at": "2022-09-04T14:38:48.214282Z",
"updated_at": "2022-09-04T14:38:48.214310Z",
"structure_string": "Li2 Br2\n1.0\n3.865781 0.000000 -0.000000\n0.000000 3.865781 0.000000\n-0.000000 0.000000 5.474660\nLi Br\n2 2\ndirect\n0.000000 0.000000 0.249904 Li\n0.500000 0.500000 0.750096 Li\n0.000000 0.000000 0.750030 Br\n0.500000 0.500000 0.249970 Br\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"Br"
],
"chemical_system": "Br-Li",
"density": 3.5252690279883296,
"density_atomic": 0.048890935139042246,
"volume": 81.81475745195489,
"volume_molar": 12.317499640523282,
"formula_full": "Li2 Br2",
"formula_reduced": "LiBr",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-117064",
"created_at": "2022-09-04T14:38:48.151017Z",
"updated_at": "2022-09-04T14:38:48.151033Z",
"structure_string": "Ba2 La2 Mn4 O12\n1.0\n5.541694 -0.001262 -0.000392\n0.001158 5.541694 -0.000378\n0.000666 0.000642 7.828789\nBa La Mn O\n2 2 4 12\ndirect\n0.500000 -0.000000 0.750000 Ba\n0.999999 0.500000 0.250001 Ba\n0.500000 0.999999 0.249998 La\n0.000001 0.499999 0.750002 La\n0.499999 0.500000 0.500000 Mn\n0.500001 0.499999 -0.000000 Mn\n-0.000000 0.000000 1.000000 Mn\n0.000001 -0.000001 0.500000 Mn\n0.250002 0.749997 0.500000 O\n0.750001 0.249998 0.000000 O\n0.000001 -0.000000 0.749998 O\n0.500000 0.499999 0.249996 O\n0.000000 -0.000000 0.250002 O\n0.250003 0.250001 0.500000 O\n0.749997 0.749998 0.500000 O\n0.249998 0.249998 0.000000 O\n0.249998 0.750001 -0.000000 O\n0.750002 0.750002 -0.000000 O\n0.500000 0.499999 0.750004 O\n0.749998 0.250002 0.500000 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Ba",
"La",
"Mn",
"O"
],
"chemical_system": "Ba-La-Mn-O",
"density": 6.659490384245182,
"density_atomic": 0.08318601098327258,
"volume": 240.42503978249047,
"volume_molar": 7.239367158993788,
"formula_full": "Ba2 La2 Mn4 O12",
"formula_reduced": "BaLaMn2O6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.677984645275862,
"spacegroup": 225
},
{
"id": "jvasp-105153",
"created_at": "2022-09-04T14:38:48.124352Z",
"updated_at": "2022-09-04T14:38:48.124381Z",
"structure_string": "Cs1 Ca3\n1.0\n5.648419 -0.000000 3.261116\n1.882806 5.325380 3.261116\n-0.000000 -0.000000 6.522232\nCs Ca\n1 3\ndirect\n0.000000 0.000000 0.000000 Cs\n0.250000 0.250000 0.250000 Ca\n0.750001 0.750000 0.750000 Ca\n0.500000 0.500000 0.500000 Ca\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cs",
"Ca"
],
"chemical_system": "Ca-Cs",
"density": 2.142570800182131,
"density_atomic": 0.020388545293238157,
"volume": 196.18859229386004,
"volume_molar": 29.53688295749691,
"formula_full": "Cs1 Ca3",
"formula_reduced": "CsCa3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-105145",
"created_at": "2022-09-04T14:38:48.082330Z",
"updated_at": "2022-09-04T14:38:48.082365Z",
"structure_string": "Dy1 Np1 Ru2\n1.0\n4.115891 -0.000000 2.376311\n1.371964 3.880499 2.376311\n-0.000000 -0.000000 4.752621\nDy Np Ru\n1 1 2\ndirect\n0.499999 0.500000 0.500000 Dy\n0.000000 0.000000 0.000000 Np\n0.749999 0.750000 0.750000 Ru\n0.250000 0.250000 0.250000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Dy",
"Np",
"Ru"
],
"chemical_system": "Dy-Np-Ru",
"density": 13.161372368772481,
"density_atomic": 0.05269572304162819,
"volume": 75.90748867493684,
"volume_molar": 11.428139538464388,
"formula_full": "Dy1 Np1 Ru2",
"formula_reduced": "DyNpRu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.342514375,
"spacegroup": 225
}
]
}