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=-updated_at&page=128",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-updated_at&page=126",
"results": [
{
"id": "jvasp-117981",
"created_at": "2022-09-04T14:38:52.068724Z",
"updated_at": "2022-09-04T14:38:52.068759Z",
"structure_string": "Ca1 N1 O1\n1.0\n4.094211 -0.000000 0.000000\n-2.047105 3.545691 -0.000000\n0.000000 0.000000 4.111984\nCa N O\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Ca\n0.333333 0.666667 0.000000 N\n0.666666 0.333334 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"N",
"O"
],
"chemical_system": "Ca-N-O",
"density": 1.9496025139402857,
"density_atomic": 0.050257251369664274,
"volume": 59.69287850490819,
"volume_molar": 11.98263055753785,
"formula_full": "Ca1 N1 O1",
"formula_reduced": "CaNO",
"formula_anonymous": "ABC",
"energy_above_hull": 2.140235723333333,
"spacegroup": 187
},
{
"id": "jvasp-117930",
"created_at": "2022-09-04T14:38:52.063684Z",
"updated_at": "2022-09-04T14:38:52.063729Z",
"structure_string": "Y1 C1 N1\n1.0\n4.048191 -0.000000 0.000000\n-2.024096 3.505837 -0.000000\n-0.000000 0.000000 4.347400\nY C N\n1 1 1\ndirect\n0.666667 0.333334 0.000000 Y\n0.000000 0.000000 0.000000 C\n0.333334 0.666668 0.000000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Y",
"C",
"N"
],
"chemical_system": "C-N-Y",
"density": 3.092962684745644,
"density_atomic": 0.048622685120902724,
"volume": 61.6995954160152,
"volume_molar": 12.385454947676475,
"formula_full": "Y1 C1 N1",
"formula_reduced": "YCN",
"formula_anonymous": "ABC",
"energy_above_hull": 4.671446233333333,
"spacegroup": 187
},
{
"id": "jvasp-120107",
"created_at": "2022-09-04T14:38:52.062164Z",
"updated_at": "2022-09-04T14:38:52.062188Z",
"structure_string": "Zn1 Cl2 O1\n1.0\n-1.779072 1.920986 5.506978\n1.779072 -1.920986 5.506978\n1.779072 1.920986 -5.506978\nZn Cl O\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Zn\n0.157038 0.657038 0.500000 Cl\n0.842962 0.342962 0.500000 Cl\n0.500000 0.000000 0.500000 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zn",
"Cl",
"O"
],
"chemical_system": "Cl-O-Zn",
"density": 3.3596884344166176,
"density_atomic": 0.0531335623389327,
"volume": 75.28198419079214,
"volume_molar": 11.333967637226124,
"formula_full": "Zn1 Cl2 O1",
"formula_reduced": "ZnCl2O",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1819480087499999,
"spacegroup": 71
},
{
"id": "jvasp-117953",
"created_at": "2022-09-04T14:38:52.053630Z",
"updated_at": "2022-09-04T14:38:52.053655Z",
"structure_string": "Si1 C1\n1.0\n3.093340 -0.000000 0.000000\n-1.546670 2.678911 -0.000000\n-0.000000 0.000000 4.023370\nSi C\n1 1\ndirect\n0.333333 0.666666 0.000000 Si\n0.000000 0.000000 0.000000 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Si",
"C"
],
"chemical_system": "C-Si",
"density": 1.9969923295383007,
"density_atomic": 0.05998657682910571,
"volume": 33.340792319217535,
"volume_molar": 10.039147219812742,
"formula_full": "Si1 C1",
"formula_reduced": "SiC",
"formula_anonymous": "AB",
"energy_above_hull": 3.1928343,
"spacegroup": 187
},
{
"id": "jvasp-120435",
"created_at": "2022-09-04T14:38:52.052426Z",
"updated_at": "2022-09-04T14:38:52.052444Z",
"structure_string": "Y6 Mn2 Au10\n1.0\n7.136131 -0.008472 3.145037\n2.047575 6.836072 3.145037\n-0.011396 -0.008472 7.798429\nY Mn Au\n6 2 10\ndirect\n0.891704 0.191351 0.620761 Y\n0.620760 0.891704 0.191352 Y\n0.191350 0.620761 0.891705 Y\n0.108295 0.808649 0.379240 Y\n0.379239 0.108296 0.808650 Y\n0.808649 0.379240 0.108296 Y\n0.654119 0.654120 0.654121 Mn\n0.345880 0.345880 0.345881 Mn\n0.060985 0.446436 0.682862 Au\n0.553563 0.317139 0.939015 Au\n0.317138 0.939014 0.553565 Au\n0.939013 0.553565 0.317140 Au\n0.000000 0.000000 0.000000 Au\n0.801750 0.801751 0.801752 Au\n0.499999 0.500000 0.500001 Au\n0.682861 0.060986 0.446436 Au\n0.198248 0.198249 0.198249 Au\n0.446435 0.682861 0.060987 Au\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Y",
"Mn",
"Au"
],
"chemical_system": "Au-Mn-Y",
"density": 11.389882390348406,
"density_atomic": 0.0472505730830687,
"volume": 380.94776053520377,
"volume_molar": 12.745116867498723,
"formula_full": "Y6 Mn2 Au10",
"formula_reduced": "Y3MnAu5",
"formula_anonymous": "AB3C5",
"energy_above_hull": 1.9001723823754797,
"spacegroup": 148
},
{
"id": "jvasp-119202",
"created_at": "2022-09-04T14:38:52.048902Z",
"updated_at": "2022-09-04T14:38:52.048930Z",
"structure_string": "Cr8 B12 Os4\n1.0\n2.915490 0.000000 0.000000\n0.000000 4.252037 0.031784\n0.000000 -0.008949 17.443303\nCr B Os\n8 12 4\ndirect\n-0.000000 0.890892 0.604325 Cr\n-0.000000 0.882774 0.274676 Cr\n0.500000 0.395309 0.892757 Cr\n0.500000 0.376499 0.563164 Cr\n0.500000 0.372870 0.235234 Cr\n0.500000 0.113928 0.718111 Cr\n0.500000 0.103625 0.389164 Cr\n0.500000 0.114211 0.064104 Cr\n0.500000 0.603207 0.012155 B\n0.500000 0.604599 0.343140 B\n0.500000 0.611038 0.670966 B\n0.500000 0.897023 0.182914 B\n0.500000 0.898685 0.511806 B\n0.500000 0.910249 0.840480 B\n-0.000000 0.388001 0.990392 B\n-0.000000 0.387095 0.651268 B\n-0.000000 0.108599 0.159964 B\n-0.000000 0.110644 0.488272 B\n-0.000000 0.128142 0.819036 B\n-0.000000 0.380342 0.323146 B\n-0.000000 0.601247 0.114359 Os\n-0.000000 0.617147 0.768232 Os\n-0.000000 0.603755 0.441381 Os\n-0.000000 0.900120 0.940949 Os\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Cr",
"B",
"Os"
],
"chemical_system": "B-Cr-Os",
"density": 10.033667000481318,
"density_atomic": 0.11098703777575887,
"volume": 216.2414682018114,
"volume_molar": 5.425985665251551,
"formula_full": "Cr8 B12 Os4",
"formula_reduced": "Cr2B3Os",
"formula_anonymous": "AB2C3",
"energy_above_hull": 5.314722925000001,
"spacegroup": 6
},
{
"id": "jvasp-120428",
"created_at": "2022-09-04T14:38:52.048462Z",
"updated_at": "2022-09-04T14:38:52.048491Z",
"structure_string": "Pr6 C2 Br10\n1.0\n7.535108 -0.022437 -1.008719\n-2.941333 8.114280 -2.868236\n-0.005585 0.015391 9.160583\nPr C Br\n6 2 10\ndirect\n0.888373 0.959048 0.237200 Pr\n0.111626 0.040952 0.762799 Pr\n0.023282 0.712383 0.915081 Pr\n0.976718 0.287617 0.084918 Pr\n0.599224 0.841222 0.796164 Pr\n0.400776 0.158777 0.203835 Pr\n0.906827 0.965659 0.954339 C\n0.093172 0.034341 0.045660 C\n0.097011 0.374335 0.817187 Br\n0.902989 0.625664 0.182812 Br\n0.165607 0.719196 0.628514 Br\n0.834393 0.280803 0.371485 Br\n0.734176 0.914453 0.530087 Br\n0.452904 0.814220 0.089331 Br\n0.265824 0.085547 0.469912 Br\n0.635932 0.517554 0.714749 Br\n0.547096 0.185779 0.910668 Br\n0.364068 0.482445 0.285250 Br\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Pr",
"C",
"Br"
],
"chemical_system": "Br-C-Pr",
"density": 4.949095450342245,
"density_atomic": 0.03215297230313903,
"volume": 559.8238268703604,
"volume_molar": 18.729654923417673,
"formula_full": "Pr6 C2 Br10",
"formula_reduced": "Pr3CBr5",
"formula_anonymous": "AB3C5",
"energy_above_hull": 1.2187833416666665,
"spacegroup": 2
},
{
"id": "jvasp-111330",
"created_at": "2022-09-04T14:38:52.046106Z",
"updated_at": "2022-09-04T14:38:52.046122Z",
"structure_string": "V1 Ga1 Ni6\n1.0\n3.554688 0.000000 0.000000\n0.000000 3.554688 0.000000\n-0.000000 -0.000000 7.088836\nV Ga Ni\n1 1 6\ndirect\n0.000000 0.000000 0.500000 V\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 -0.000000 Ni\n0.500000 0.500000 0.500000 Ni\n0.500000 0.000000 0.256689 Ni\n0.500000 0.000000 0.743311 Ni\n-0.000000 0.500000 0.256689 Ni\n-0.000000 0.500000 0.743311 Ni\n",
"nsites": 8,
"nelements": 3,
"elements": [
"V",
"Ga",
"Ni"
],
"chemical_system": "Ga-Ni-V",
"density": 8.765395804093796,
"density_atomic": 0.08931246618798307,
"volume": 89.57316197228013,
"volume_molar": 6.7427773714418775,
"formula_full": "V1 Ga1 Ni6",
"formula_reduced": "VGaNi6",
"formula_anonymous": "ABC6",
"energy_above_hull": 1.436638865625,
"spacegroup": 123
},
{
"id": "jvasp-118333",
"created_at": "2022-09-04T14:38:52.043872Z",
"updated_at": "2022-09-04T14:38:52.043899Z",
"structure_string": "Te1 O1 F1\n1.0\n3.983545 -0.000000 0.000000\n-1.991772 3.449851 -0.000000\n0.000000 -0.000000 3.191086\nTe O F\n1 1 1\ndirect\n0.666667 0.333333 0.000000 Te\n0.333334 0.666667 0.000000 O\n0.000000 0.000000 0.000000 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Te",
"O",
"F"
],
"chemical_system": "F-O-Te",
"density": 6.156802138110196,
"density_atomic": 0.0684089115417673,
"volume": 43.85393558218419,
"volume_molar": 8.803152431862857,
"formula_full": "Te1 O1 F1",
"formula_reduced": "TeOF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.5915271830555558,
"spacegroup": 187
},
{
"id": "jvasp-122042",
"created_at": "2022-09-04T14:38:52.042617Z",
"updated_at": "2022-09-04T14:38:52.042641Z",
"structure_string": "Tb4 Ge10 Rh6\n1.0\n7.853013 0.081000 2.917157\n-1.306040 7.744071 2.917157\n0.062515 0.074719 5.998515\nTb Ge Rh\n4 10 6\ndirect\n0.864279 0.593723 0.770977 Tb\n0.406277 0.135721 0.729024 Tb\n0.135720 0.406278 0.229024 Tb\n0.593722 0.864279 0.270977 Tb\n0.220237 0.779762 0.250000 Ge\n0.779762 0.220238 0.750000 Ge\n0.499993 0.500007 0.250000 Ge\n0.500006 0.499993 0.750000 Ge\n0.779772 0.220228 0.250001 Ge\n0.260239 0.067592 0.336113 Ge\n0.932407 0.739761 0.163888 Ge\n0.739760 0.932408 0.663888 Ge\n0.067592 0.260239 0.836112 Ge\n0.220227 0.779772 0.750000 Ge\n-0.000012 0.000011 0.750000 Rh\n0.250833 0.535767 0.606710 Rh\n0.464232 0.749166 0.893291 Rh\n0.749166 0.464233 0.393291 Rh\n0.535767 0.250834 0.106710 Rh\n0.000011 -0.000011 0.250000 Rh\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Tb",
"Ge",
"Rh"
],
"chemical_system": "Ge-Rh-Tb",
"density": 9.079463924075359,
"density_atomic": 0.055243101403056445,
"volume": 362.03615459745816,
"volume_molar": 10.901163415975072,
"formula_full": "Tb4 Ge10 Rh6",
"formula_reduced": "Tb2Ge5Rh3",
"formula_anonymous": "A2B3C5",
"energy_above_hull": 1.7843755550000002,
"spacegroup": 72
},
{
"id": "jvasp-117583",
"created_at": "2022-09-04T14:38:52.042146Z",
"updated_at": "2022-09-04T14:38:52.042174Z",
"structure_string": "Ba1 In1 F1\n1.0\n3.785722 0.000000 0.000000\n0.000000 3.785722 -0.000000\n-0.000000 0.000000 8.076666\nBa In F\n1 1 1\ndirect\n0.000000 0.000000 0.423152 Ba\n0.000000 0.000000 -0.005190 In\n0.000000 0.000000 0.721217 F\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"In",
"F"
],
"chemical_system": "Ba-F-In",
"density": 3.889722139444614,
"density_atomic": 0.025917415625089566,
"volume": 115.75228191717639,
"volume_molar": 23.235884499881298,
"formula_full": "Ba1 In1 F1",
"formula_reduced": "BaInF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-120032",
"created_at": "2022-09-04T14:38:52.040096Z",
"updated_at": "2022-09-04T14:38:52.040122Z",
"structure_string": "Hf1 Br1 N1\n1.0\n3.405759 -0.000000 0.000000\n-0.000000 3.405759 -0.000000\n-0.000000 -0.000000 6.620372\nHf Br N\n1 1 1\ndirect\n0.000000 0.000000 -0.012162 Hf\n0.000000 0.000000 0.381572 Br\n0.000000 0.000000 0.709568 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Hf",
"Br",
"N"
],
"chemical_system": "Br-Hf-N",
"density": 5.890431332851151,
"density_atomic": 0.03906708753223038,
"volume": 76.7909816037604,
"volume_molar": 15.414870010547189,
"formula_full": "Hf1 Br1 N1",
"formula_reduced": "HfBrN",
"formula_anonymous": "ABC",
"energy_above_hull": 3.387876785,
"spacegroup": 99
}
]
}