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=1268",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=spacegroup&page=1266",
"results": [
{
"id": "jvasp-102848",
"created_at": "2022-09-04T14:36:53.259278Z",
"updated_at": "2022-09-04T14:36:53.259304Z",
"structure_string": "Li1 Fe1 F4\n1.0\n4.628993 0.042218 0.000000\n-0.221132 4.623901 0.000000\n-0.000000 -0.000000 3.066839\nLi Fe F\n1 1 4\ndirect\n0.000000 0.000000 0.500000 Li\n0.500000 0.500000 -0.000000 Fe\n0.793894 0.793895 -0.000000 F\n0.694384 0.305616 0.500000 F\n0.206105 0.206106 -0.000000 F\n0.305616 0.694384 0.500000 F\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Li",
"Fe",
"F"
],
"chemical_system": "F-Fe-Li",
"density": 3.509129181622185,
"density_atomic": 0.0913641541045804,
"volume": 65.67126964402333,
"volume_molar": 6.591360494737059,
"formula_full": "Li1 Fe1 F4",
"formula_reduced": "LiFeF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.2265294383333332,
"spacegroup": 65
},
{
"id": "jvasp-105518",
"created_at": "2022-09-04T14:36:54.096208Z",
"updated_at": "2022-09-04T14:36:54.096238Z",
"structure_string": "Er1 Ga2 Cu3\n1.0\n5.066853 0.031320 0.000000\n-2.432364 4.444950 0.000000\n0.000000 0.000000 4.123997\nEr Ga Cu\n1 2 3\ndirect\n0.500000 0.500000 -0.000000 Er\n0.000000 0.500000 0.500000 Ga\n0.500000 -0.000000 0.500000 Ga\n0.161910 0.838090 -0.000000 Cu\n0.838090 0.161909 -0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Er",
"Ga",
"Cu"
],
"chemical_system": "Cu-Er-Ga",
"density": 8.861659012235224,
"density_atomic": 0.06438151290828899,
"volume": 93.19445488252128,
"volume_molar": 9.353835422566874,
"formula_full": "Er1 Ga2 Cu3",
"formula_reduced": "ErGa2Cu3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.0,
"spacegroup": 65
},
{
"id": "jvasp-102673",
"created_at": "2022-09-04T14:36:54.160368Z",
"updated_at": "2022-09-04T14:36:54.160390Z",
"structure_string": "Ta1 V1\n1.0\n2.816323 -0.002697 0.000000\n-0.979973 2.640328 0.000000\n-0.000000 -0.000000 4.289992\nTa V\n1 1\ndirect\n0.000000 0.000000 0.000000 Ta\n0.500000 0.500000 0.500000 V\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ta",
"V"
],
"chemical_system": "Ta-V",
"density": 12.075010588742574,
"density_atomic": 0.06271732967592378,
"volume": 31.889112791225376,
"volume_molar": 9.602036297013786,
"formula_full": "Ta1 V1",
"formula_reduced": "TaV",
"formula_anonymous": "AB",
"energy_above_hull": 3.7219167,
"spacegroup": 65
},
{
"id": "jvasp-102729",
"created_at": "2022-09-04T14:36:54.648167Z",
"updated_at": "2022-09-04T14:36:54.648185Z",
"structure_string": "La1 Al1 Cu4\n1.0\n5.175731 0.005374 0.000000\n-2.454608 4.556657 0.000000\n0.000000 0.000000 4.177687\nLa Al Cu\n1 1 4\ndirect\n0.500000 0.500000 -0.000000 La\n0.000000 0.000000 0.500000 Al\n0.164742 0.835258 -0.000000 Cu\n0.835257 0.164742 -0.000000 Cu\n-0.000000 0.500000 0.500000 Cu\n0.500000 -0.000000 0.500000 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"La",
"Al",
"Cu"
],
"chemical_system": "Al-Cu-La",
"density": 7.0757915578042665,
"density_atomic": 0.06086315678807246,
"volume": 98.5818073960935,
"volume_molar": 9.894558675241404,
"formula_full": "La1 Al1 Cu4",
"formula_reduced": "LaAlCu4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.2932849333333335,
"spacegroup": 65
},
{
"id": "jvasp-48544",
"created_at": "2022-09-04T14:36:55.331668Z",
"updated_at": "2022-09-04T14:36:55.331686Z",
"structure_string": "Li2 V1 F4\n1.0\n5.156880 0.041755 0.000000\n1.912138 4.789456 0.000000\n0.000000 0.000000 3.083262\nLi V F\n2 1 4\ndirect\n0.000000 0.500000 0.500000 Li\n0.500000 0.000000 0.500000 Li\n0.000000 0.000000 0.000000 V\n0.240609 0.240609 0.000000 F\n0.237757 0.762244 0.500000 F\n0.762243 0.237758 0.500000 F\n0.759391 0.759392 0.000000 F\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Li",
"V",
"F"
],
"chemical_system": "F-Li-V",
"density": 3.0805415573219257,
"density_atomic": 0.09221903615924203,
"volume": 75.90623684151868,
"volume_molar": 6.53025775459319,
"formula_full": "Li2 V1 F4",
"formula_reduced": "Li2VF4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.4366993328571428,
"spacegroup": 65
},
{
"id": "jvasp-50209",
"created_at": "2022-09-04T14:36:55.471516Z",
"updated_at": "2022-09-04T14:36:55.471538Z",
"structure_string": "Zn1 Re1 O4\n1.0\n3.252801 3.354378 0.000000\n-3.252801 3.354378 0.000000\n0.000000 0.000000 3.095678\nZn Re O\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Re\n0.215450 0.784551 0.500000 O\n0.311389 0.311389 0.000000 O\n0.688611 0.688611 0.000000 O\n0.784551 0.215450 0.500000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Zn",
"Re",
"O"
],
"chemical_system": "O-Re-Zn",
"density": 7.757995692625139,
"density_atomic": 0.08881697510995908,
"volume": 67.55465374239274,
"volume_molar": 6.780393897162499,
"formula_full": "Zn1 Re1 O4",
"formula_reduced": "ZnReO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.5106954000000004,
"spacegroup": 65
},
{
"id": "jvasp-102845",
"created_at": "2022-09-04T14:36:55.872620Z",
"updated_at": "2022-09-04T14:36:55.872645Z",
"structure_string": "Li1 Co3 O4\n1.0\n5.060824 -0.101120 0.000000\n-1.682618 4.773988 0.000000\n0.000000 -0.000000 2.896089\nLi Co O\n1 3 4\ndirect\n0.499999 0.500000 0.500000 Li\n0.500000 -0.000000 -0.000000 Co\n0.000000 0.000000 0.500000 Co\n-0.000000 0.500000 -0.000000 Co\n0.771096 0.771097 -0.000000 O\n0.231767 0.768233 0.500000 O\n0.768232 0.231767 0.500000 O\n0.228903 0.228903 -0.000000 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Li",
"Co",
"O"
],
"chemical_system": "Co-Li-O",
"density": 5.921024783316266,
"density_atomic": 0.1151449291546281,
"volume": 69.47765792844253,
"volume_molar": 5.230052946502637,
"formula_full": "Li1 Co3 O4",
"formula_reduced": "LiCo3O4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 2.7921270875,
"spacegroup": 65
},
{
"id": "jvasp-103135",
"created_at": "2022-09-04T14:36:56.562833Z",
"updated_at": "2022-09-04T14:36:56.562854Z",
"structure_string": "Ta2 O5\n1.0\n3.890914 0.000000 0.000000\n0.000000 3.753912 0.914451\n0.000000 0.318899 6.840985\nTa O\n2 5\ndirect\n0.000000 0.354210 0.791420 Ta\n0.000000 0.645789 0.208579 Ta\n0.500000 0.350235 0.798816 O\n0.500000 0.649765 0.201183 O\n0.000000 0.814669 0.870416 O\n0.000000 0.185331 0.129583 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 7,
"nelements": 2,
"elements": [
"Ta",
"O"
],
"chemical_system": "O-Ta",
"density": 7.427993659044523,
"density_atomic": 0.07086039693483208,
"volume": 98.7857858944491,
"volume_molar": 8.498598682051357,
"formula_full": "Ta2 O5",
"formula_reduced": "Ta2O5",
"formula_anonymous": "A2B5",
"energy_above_hull": 3.7228579857142856,
"spacegroup": 65
},
{
"id": "jvasp-104825",
"created_at": "2022-09-04T14:36:56.882670Z",
"updated_at": "2022-09-04T14:36:56.882732Z",
"structure_string": "Li1 Mn1 F4\n1.0\n4.541280 0.020520 0.000000\n-0.200788 4.536886 0.000000\n-0.000000 -0.000000 3.138187\nLi Mn F\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500001 0.500000 Mn\n0.695654 0.304346 -0.000000 F\n0.304346 0.695655 -0.000000 F\n0.209473 0.209473 0.500000 F\n0.790527 0.790528 0.500000 F\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Li",
"Mn",
"F"
],
"chemical_system": "F-Li-Mn",
"density": 3.540180776796718,
"density_atomic": 0.09277894820310133,
"volume": 64.66984284910698,
"volume_molar": 6.490848276073361,
"formula_full": "Li1 Mn1 F4",
"formula_reduced": "LiMnF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.343171395229885,
"spacegroup": 65
},
{
"id": "jvasp-52281",
"created_at": "2022-09-04T14:36:57.592539Z",
"updated_at": "2022-09-04T14:36:57.592562Z",
"structure_string": "Mg3 Zn1 O4\n1.0\n0.000000 2.130036 2.130036\n-4.254379 2.126179 -2.126179\n-4.254379 -2.126179 2.126179\nMg Zn O\n3 1 4\ndirect\n-0.000000 0.500000 0.500000 Mg\n0.500001 -0.000000 0.500000 Mg\n0.500001 0.500000 -0.000000 Mg\n0.000000 0.000000 0.000000 Zn\n-0.000000 0.746684 0.746684 O\n0.500001 0.256149 0.743851 O\n0.500001 0.743851 0.256149 O\n-0.000000 0.253316 0.253316 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Zn",
"O"
],
"chemical_system": "Mg-O-Zn",
"density": 4.359216239325104,
"density_atomic": 0.10380231791589503,
"volume": 77.06956993467077,
"volume_molar": 5.801547480740642,
"formula_full": "Mg3 Zn1 O4",
"formula_reduced": "Mg3ZnO4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.4741401937499999,
"spacegroup": 65
},
{
"id": "jvasp-105305",
"created_at": "2022-09-04T14:36:57.484786Z",
"updated_at": "2022-09-04T14:36:57.484824Z",
"structure_string": "Sm2 Cd1 Ni2\n1.0\n7.439722 0.014425 0.000000\n-6.407666 3.780408 0.000000\n0.000000 0.000000 3.745849\nSm Cd Ni\n2 1 2\ndirect\n0.636847 0.363152 0.500000 Sm\n0.363152 0.636848 0.500000 Sm\n0.000000 0.000000 0.000000 Cd\n0.799510 0.200488 -0.000000 Ni\n0.200489 0.799511 -0.000000 Ni\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sm",
"Cd",
"Ni"
],
"chemical_system": "Cd-Ni-Sm",
"density": 8.334479545264198,
"density_atomic": 0.04730417056719573,
"volume": 105.69892548686556,
"volume_molar": 12.730676149253123,
"formula_full": "Sm2 Cd1 Ni2",
"formula_reduced": "Sm2CdNi2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.5920944600000002,
"spacegroup": 65
},
{
"id": "jvasp-101476",
"created_at": "2022-09-04T14:36:58.142973Z",
"updated_at": "2022-09-04T14:36:58.143005Z",
"structure_string": "Mn1 Ni3 O4\n1.0\n5.555638 -0.428286 0.000000\n-2.265474 5.090793 0.000000\n0.000000 0.000000 2.858652\nMn Ni O\n1 3 4\ndirect\n0.500000 0.499999 0.000000 Mn\n0.000000 0.500000 0.500000 Ni\n0.500000 -0.000000 0.500000 Ni\n0.000000 0.000000 0.000000 Ni\n0.211081 0.788919 0.000000 O\n0.728660 0.728659 0.500000 O\n0.271340 0.271340 0.500000 O\n0.788920 0.211080 0.000000 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mn",
"Ni",
"O"
],
"chemical_system": "Mn-Ni-O",
"density": 6.2744312255415435,
"density_atomic": 0.10246367083695684,
"volume": 78.07645319217414,
"volume_molar": 5.877342389560299,
"formula_full": "Mn1 Ni3 O4",
"formula_reduced": "MnNi3O4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 2.366978555172414,
"spacegroup": 65
}
]
}