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=37",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-updated_at&page=35",
"results": [
{
"id": "jvasp-122919",
"created_at": "2022-09-04T14:38:54.605727Z",
"updated_at": "2022-09-04T14:38:54.605752Z",
"structure_string": "V1 As1\n1.0\n3.080096 0.000000 0.000000\n0.000000 3.080096 0.000000\n-0.000000 0.000000 3.080096\nV As\n1 1\ndirect\n0.500001 0.500001 0.500001 V\n0.000000 0.000000 0.000000 As\n",
"nsites": 2,
"nelements": 2,
"elements": [
"V",
"As"
],
"chemical_system": "As-V",
"density": 7.152448895357694,
"density_atomic": 0.06844429231670868,
"volume": 29.22084416835673,
"volume_molar": 8.79860183539347,
"formula_full": "V1 As1",
"formula_reduced": "VAs",
"formula_anonymous": "AB",
"energy_above_hull": null,
"spacegroup": 221
},
{
"id": "jvasp-120985",
"created_at": "2022-09-04T14:38:54.604984Z",
"updated_at": "2022-09-04T14:38:54.605011Z",
"structure_string": "Ca1 Al1 As1\n1.0\n3.097720 0.000000 -0.000000\n-0.000000 3.097720 0.000000\n-0.000000 -0.000000 8.440083\nCa Al As\n1 1 1\ndirect\n0.000000 0.000000 0.097693 Ca\n0.000000 0.000000 0.458973 Al\n0.000000 0.000000 0.756161 As\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Al",
"As"
],
"chemical_system": "Al-As-Ca",
"density": 2.911043633602079,
"density_atomic": 0.03704164095098719,
"volume": 80.98993249163945,
"volume_molar": 16.257759120251677,
"formula_full": "Ca1 Al1 As1",
"formula_reduced": "CaAlAs",
"formula_anonymous": "ABC",
"energy_above_hull": 1.1540483233333334,
"spacegroup": 99
},
{
"id": "jvasp-122970",
"created_at": "2022-09-04T14:38:54.603410Z",
"updated_at": "2022-09-04T14:38:54.603438Z",
"structure_string": "Pr1 V1\n1.0\n3.567791 0.000000 0.000000\n-0.000000 3.567791 -0.000000\n0.000000 -0.000000 3.567791\nPr V\n1 1\ndirect\n0.000000 0.000000 0.000000 Pr\n0.500000 0.500000 0.500000 V\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Pr",
"V"
],
"chemical_system": "Pr-V",
"density": 7.014726776999294,
"density_atomic": 0.044038425042414196,
"volume": 45.4148847983043,
"volume_molar": 13.674741442728635,
"formula_full": "Pr1 V1",
"formula_reduced": "PrV",
"formula_anonymous": "AB",
"energy_above_hull": null,
"spacegroup": 221
},
{
"id": "jvasp-123560",
"created_at": "2022-09-04T14:38:54.597600Z",
"updated_at": "2022-09-04T14:38:54.597628Z",
"structure_string": "Ca1 P3\n1.0\n3.217010 -0.000000 -1.030127\n-0.075024 4.446344 -0.234294\n0.063997 -0.322795 5.738163\nCa P\n1 3\ndirect\n0.342187 -0.022927 0.684374 Ca\n0.619768 0.092626 0.239534 P\n0.117716 0.430998 0.235430 P\n0.920331 0.499299 0.840661 P\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ca",
"P"
],
"chemical_system": "Ca-P",
"density": 2.6899142343708773,
"density_atomic": 0.0487191853264749,
"volume": 82.10317913149353,
"volume_molar": 12.360922539333714,
"formula_full": "Ca1 P3",
"formula_reduced": "CaP3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.99047673,
"spacegroup": 8
},
{
"id": "jvasp-122602",
"created_at": "2022-09-04T14:38:54.596652Z",
"updated_at": "2022-09-04T14:38:54.596673Z",
"structure_string": "Pm1 Sn7\n1.0\n6.798320 -0.000000 0.000000\n-0.000000 6.798320 -0.000000\n0.000000 -0.000000 6.798320\nPm Sn\n1 7\ndirect\n0.000000 0.000000 0.500000 Pm\n0.260082 0.260082 0.760082 Sn\n0.000000 0.500000 0.000000 Sn\n0.260082 0.739918 0.239918 Sn\n0.500000 0.000000 0.000000 Sn\n0.739918 0.260082 0.239918 Sn\n0.500000 0.500000 0.500000 Sn\n0.739918 0.739918 0.760082 Sn\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Pm",
"Sn"
],
"chemical_system": "Pm-Sn",
"density": 5.157993092622683,
"density_atomic": 0.025461569887284187,
"volume": 314.1990079722184,
"volume_molar": 23.651883158263267,
"formula_full": "Pm1 Sn7",
"formula_reduced": "PmSn7",
"formula_anonymous": "AB7",
"energy_above_hull": 0.6735253843750001,
"spacegroup": 215
},
{
"id": "jvasp-120875",
"created_at": "2022-09-04T14:38:54.595171Z",
"updated_at": "2022-09-04T14:38:54.595203Z",
"structure_string": "Ba1 Zr1 Se1\n1.0\n3.520576 -0.000000 0.000000\n0.000000 3.520576 0.000000\n0.000000 0.000000 8.735876\nBa Zr Se\n1 1 1\ndirect\n0.000000 0.000000 0.431830 Ba\n0.000000 0.000000 0.052635 Zr\n0.000000 0.000000 0.778416 Se\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Zr",
"Se"
],
"chemical_system": "Ba-Se-Zr",
"density": 4.71602223562098,
"density_atomic": 0.027706862265103414,
"volume": 108.27642521536903,
"volume_molar": 21.73519578788552,
"formula_full": "Ba1 Zr1 Se1",
"formula_reduced": "BaZrSe",
"formula_anonymous": "ABC",
"energy_above_hull": 1.6933946122222223,
"spacegroup": 99
},
{
"id": "jvasp-120956",
"created_at": "2022-09-04T14:38:54.588782Z",
"updated_at": "2022-09-04T14:38:54.588804Z",
"structure_string": "Ca3 Te1\n1.0\n5.468893 0.663963 -0.490879\n-1.778909 -8.896018 -0.703982\n0.024716 -2.534299 -3.175565\nCa Te\n3 1\ndirect\n0.060298 0.564103 0.439748 Ca\n0.652668 0.748766 0.662912 Ca\n0.356531 0.156438 0.051450 Ca\n0.856621 0.156436 0.551392 Te\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ca",
"Te"
],
"chemical_system": "Ca-Te",
"density": 2.9680663204250313,
"density_atomic": 0.028848524694419186,
"volume": 138.65527067225761,
"volume_molar": 20.87503892760588,
"formula_full": "Ca3 Te1",
"formula_reduced": "Ca3Te",
"formula_anonymous": "AB3",
"energy_above_hull": 0.07828271,
"spacegroup": 71
},
{
"id": "jvasp-121348",
"created_at": "2022-09-04T14:38:54.588611Z",
"updated_at": "2022-09-04T14:38:54.588647Z",
"structure_string": "K1 Ba3 Bi4 O12\n1.0\n6.157646 -0.000000 0.000000\n0.000000 6.208003 0.000000\n-0.000000 -0.000000 8.699477\nK Ba Bi O\n1 3 4 12\ndirect\n0.500000 0.008616 0.500000 K\n-0.000000 0.495978 -0.000000 Ba\n0.500000 0.996179 -0.000000 Ba\n-0.000000 0.493366 0.500000 Ba\n-0.000000 0.998000 0.252200 Bi\n0.500000 0.500767 0.747936 Bi\n-0.000000 0.998000 0.747800 Bi\n0.500000 0.500767 0.252064 Bi\n0.752084 0.746370 0.788451 O\n0.242623 0.258626 0.273963 O\n0.242623 0.258626 0.726037 O\n0.752084 0.746370 0.211549 O\n0.247917 0.746370 0.788451 O\n0.500000 0.560257 0.500000 O\n0.500000 0.440253 -0.000000 O\n-0.000000 0.935321 0.500000 O\n0.247917 0.746370 0.211549 O\n-0.000000 0.052509 -0.000000 O\n0.757377 0.258626 0.273963 O\n0.757377 0.258626 0.726037 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"K",
"Ba",
"Bi",
"O"
],
"chemical_system": "Ba-Bi-K-O",
"density": 7.385087431229666,
"density_atomic": 0.06014094049371697,
"volume": 332.5521655599888,
"volume_molar": 10.013379755225383,
"formula_full": "K1 Ba3 Bi4 O12",
"formula_reduced": "KBa3(BiO3)4",
"formula_anonymous": "AB3C4D12",
"energy_above_hull": 1.8582117555,
"spacegroup": 25
},
{
"id": "jvasp-122496",
"created_at": "2022-09-04T14:38:54.586923Z",
"updated_at": "2022-09-04T14:38:54.586958Z",
"structure_string": "Ba2 Y1 Co3 O8\n1.0\n3.862903 0.000000 0.000001\n-0.000002 3.862909 -0.000002\n-0.000000 0.000000 11.706010\nBa Y Co O\n2 1 3 8\ndirect\n0.499999 0.500000 0.172042 Ba\n0.499999 0.500000 0.828001 Ba\n0.500001 0.500000 0.499995 Y\n0.000000 0.000001 0.347532 Co\n0.000000 -0.000000 0.000045 Co\n0.000001 0.999999 0.652464 Co\n0.000000 0.500001 0.380068 O\n0.500000 0.000001 0.380067 O\n0.500001 -0.000000 0.000018 O\n0.999998 -0.000000 0.185990 O\n0.000000 0.500000 0.619887 O\n0.500001 0.999999 0.619887 O\n0.999998 -0.000000 0.813984 O\n0.000001 0.500000 0.000018 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Ba",
"Y",
"Co",
"O"
],
"chemical_system": "Ba-Co-O-Y",
"density": 6.3535856757476274,
"density_atomic": 0.08014766321866286,
"volume": 174.67758182549252,
"volume_molar": 7.5138070383538125,
"formula_full": "Ba2 Y1 Co3 O8",
"formula_reduced": "Ba2YCo3O8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.633249149285714,
"spacegroup": 123
},
{
"id": "jvasp-122083",
"created_at": "2022-09-04T14:38:54.585742Z",
"updated_at": "2022-09-04T14:38:54.585771Z",
"structure_string": "K8 V4 O18\n1.0\n8.108066 -0.024275 0.000000\n-0.933109 8.054231 0.000000\n-0.000000 -0.000000 8.019090\nK V O\n8 4 18\ndirect\n0.463106 0.536894 0.250000 K\n0.536894 0.463106 0.750000 K\n0.987533 0.012467 0.250000 K\n0.012467 0.987533 0.750000 K\n0.905146 0.540848 0.250000 K\n0.540848 0.905146 0.750000 K\n0.094854 0.459152 0.750000 K\n0.459152 0.094854 0.250000 K\n0.774639 0.225361 0.977064 V\n0.225361 0.774638 0.022936 V\n0.774639 0.225361 0.522936 V\n0.225361 0.774638 0.477064 V\n0.321605 0.164419 0.750000 O\n0.164419 0.321605 0.250000 O\n0.768613 0.231387 0.750000 O\n0.231387 0.768613 0.250000 O\n0.645401 0.354599 0.057166 O\n0.354599 0.645400 0.942834 O\n0.645401 0.354599 0.442834 O\n0.354599 0.645400 0.557166 O\n0.024666 0.716371 0.963565 O\n0.975335 0.283628 0.036435 O\n0.283629 0.975334 0.536435 O\n0.975335 0.283628 0.463565 O\n0.716371 0.024665 0.036435 O\n0.835581 0.678395 0.750000 O\n0.716371 0.024665 0.463565 O\n0.024666 0.716371 0.536435 O\n0.283629 0.975334 0.963565 O\n0.678395 0.835580 0.250000 O\n",
"nsites": 30,
"nelements": 3,
"elements": [
"K",
"V",
"O"
],
"chemical_system": "K-O-V",
"density": 2.552006770805334,
"density_atomic": 0.057306709806828456,
"volume": 523.4989079136648,
"volume_molar": 10.508613703874557,
"formula_full": "K8 V4 O18",
"formula_reduced": "K4V2O9",
"formula_anonymous": "A2B4C9",
"energy_above_hull": null,
"spacegroup": 63
},
{
"id": "jvasp-121016",
"created_at": "2022-09-04T14:38:54.584517Z",
"updated_at": "2022-09-04T14:38:54.584544Z",
"structure_string": "H2 Pb2 F2\n1.0\n4.859390 0.000000 -0.020532\n0.000000 4.345323 0.000000\n-2.214521 0.000000 5.172736\nH Pb F\n2 2 2\ndirect\n0.548680 0.250000 0.626501 H\n0.451321 0.750000 0.373499 H\n0.650248 0.750000 0.785606 Pb\n0.349752 0.250000 0.214394 Pb\n0.164126 0.750000 0.807276 F\n0.835874 0.250000 0.192724 F\n",
"nsites": 6,
"nelements": 3,
"elements": [
"H",
"Pb",
"F"
],
"chemical_system": "F-H-Pb",
"density": 6.9208861928774414,
"density_atomic": 0.055031761347213576,
"volume": 109.02794773629026,
"volume_molar": 10.94302746736439,
"formula_full": "H2 Pb2 F2",
"formula_reduced": "HPbF",
"formula_anonymous": "ABC",
"energy_above_hull": 0.4671137008333333,
"spacegroup": 11
},
{
"id": "jvasp-123851",
"created_at": "2022-09-04T14:38:54.583820Z",
"updated_at": "2022-09-04T14:38:54.583847Z",
"structure_string": "Sr1 Bi5\n1.0\n2.283295 -3.954793 0.000000\n2.283295 3.954793 -0.000000\n-0.000000 -0.000000 12.139996\nSr Bi\n1 5\ndirect\n0.000000 0.000000 0.249992 Sr\n0.666665 0.333332 0.067058 Bi\n0.666665 0.333332 0.585339 Bi\n0.333332 0.666665 0.432941 Bi\n0.333332 0.666665 0.914662 Bi\n0.000000 0.000000 0.750008 Bi\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Sr",
"Bi"
],
"chemical_system": "Bi-Sr",
"density": 8.577513751032745,
"density_atomic": 0.02736635325269036,
"volume": 219.24733429398913,
"volume_molar": 22.005638472886297,
"formula_full": "Sr1 Bi5",
"formula_reduced": "SrBi5",
"formula_anonymous": "AB5",
"energy_above_hull": null,
"spacegroup": 164
}
]
}