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=nelements&page=1264",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=1262",
"results": [
{
"id": "jvasp-119946",
"created_at": "2022-09-04T14:38:54.355917Z",
"updated_at": "2022-09-04T14:38:54.355945Z",
"structure_string": "Ba1 Cr1 F2\n1.0\n3.813434 0.000000 0.000000\n0.000000 3.813434 -0.000000\n-0.000000 0.000000 5.479047\nBa Cr F\n1 1 2\ndirect\n0.499999 0.499999 0.823311 Ba\n0.000000 0.000000 0.384567 Cr\n0.000000 0.000000 0.992609 F\n0.499999 0.499999 0.299512 F\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Cr",
"F"
],
"chemical_system": "Ba-Cr-F",
"density": 4.7374983467719,
"density_atomic": 0.05020217077546182,
"volume": 79.67782942874553,
"volume_molar": 11.995777606779399,
"formula_full": "Ba1 Cr1 F2",
"formula_reduced": "BaCrF2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5794284837500001,
"spacegroup": 99
},
{
"id": "jvasp-119954",
"created_at": "2022-09-04T14:38:54.365775Z",
"updated_at": "2022-09-04T14:38:54.365802Z",
"structure_string": "Ba1 Mo1 O1\n1.0\n3.086271 0.000000 0.000000\n0.000000 3.086271 0.000000\n0.000000 -0.000000 7.247120\nBa Mo O\n1 1 1\ndirect\n0.000000 0.000000 0.330807 Ba\n0.000000 0.000000 0.748022 Mo\n0.000000 0.000000 -0.011563 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Mo",
"O"
],
"chemical_system": "Ba-Mo-O",
"density": 5.996243633068672,
"density_atomic": 0.04345979626865745,
"volume": 69.02931577163316,
"volume_molar": 13.856808538108766,
"formula_full": "Ba1 Mo1 O1",
"formula_reduced": "BaMoO",
"formula_anonymous": "ABC",
"energy_above_hull": 2.3985184566666664,
"spacegroup": 99
},
{
"id": "jvasp-120927",
"created_at": "2022-09-04T14:38:54.389684Z",
"updated_at": "2022-09-04T14:38:54.389712Z",
"structure_string": "Cd1 C2 N1\n1.0\n2.671776 0.000000 -0.000000\n0.000000 2.671776 0.000000\n0.000000 -0.000000 5.285827\nCd C N\n1 2 1\ndirect\n0.500001 0.500001 0.500000 Cd\n0.000000 0.500001 0.165098 C\n0.500001 0.000000 -0.165098 C\n0.000000 0.000000 0.000000 N\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cd",
"C",
"N"
],
"chemical_system": "C-Cd-N",
"density": 6.620591473214895,
"density_atomic": 0.10601003005185257,
"volume": 37.732278710264346,
"volume_molar": 5.680727339719079,
"formula_full": "Cd1 C2 N1",
"formula_reduced": "CdC2N",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.297293250000001,
"spacegroup": 115
},
{
"id": "jvasp-122003",
"created_at": "2022-09-04T14:38:54.393111Z",
"updated_at": "2022-09-04T14:38:54.393148Z",
"structure_string": "Li4 Co2 O6\n1.0\n2.822802 -0.000000 0.000000\n-1.411401 2.444618 0.000000\n-0.000000 -0.000000 14.642146\nLi Co O\n4 2 6\ndirect\n0.333333 0.666667 0.337345 Li\n0.666666 0.333334 0.662655 Li\n0.000000 0.000000 0.000000 Li\n0.000000 0.000000 0.500000 Li\n0.333333 0.666667 0.840326 Co\n0.666666 0.333334 0.159674 Co\n0.333333 0.666667 0.590546 O\n0.666666 0.333334 0.911461 O\n0.000000 0.000000 0.226019 O\n0.333333 0.666667 0.088539 O\n0.666666 0.333334 0.409454 O\n0.000000 0.000000 0.773982 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Li",
"Co",
"O"
],
"chemical_system": "Co-Li-O",
"density": 3.9709829939950505,
"density_atomic": 0.11876407522693257,
"volume": 101.04065540922694,
"volume_molar": 5.070675411308501,
"formula_full": "Li4 Co2 O6",
"formula_reduced": "Li2CoO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.9356569,
"spacegroup": 164
},
{
"id": "jvasp-122062",
"created_at": "2022-09-04T14:38:54.400900Z",
"updated_at": "2022-09-04T14:38:54.400925Z",
"structure_string": "Dy16 Ga6 Co2\n1.0\n9.941668 -0.000000 0.000000\n-4.970833 8.609737 0.000000\n-0.000000 -0.000000 6.875689\nDy Ga Co\n16 6 2\ndirect\n0.172469 0.827531 0.511494 Dy\n0.000000 0.000000 0.732259 Dy\n0.000000 0.000000 0.232259 Dy\n0.536827 0.073652 0.707812 Dy\n0.926349 0.463174 0.707812 Dy\n0.463174 0.926349 0.207812 Dy\n0.073652 0.536827 0.207812 Dy\n0.463174 0.536827 0.207812 Dy\n0.536827 0.463174 0.707812 Dy\n0.333334 0.666667 0.827191 Dy\n0.827532 0.655063 0.011494 Dy\n0.344938 0.172469 0.011494 Dy\n0.827531 0.172469 0.011494 Dy\n0.172469 0.344938 0.511494 Dy\n0.655063 0.827531 0.511494 Dy\n0.666667 0.333333 0.327191 Dy\n0.163787 0.836213 0.958964 Ga\n0.672427 0.836213 0.958964 Ga\n0.163787 0.327574 0.958964 Ga\n0.836213 0.163787 0.458964 Ga\n0.327574 0.163787 0.458964 Ga\n0.836214 0.672426 0.458964 Ga\n0.333334 0.666667 0.443160 Co\n0.666667 0.333333 0.943160 Co\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Dy",
"Ga",
"Co"
],
"chemical_system": "Co-Dy-Ga",
"density": 8.848875608455415,
"density_atomic": 0.04077987366143424,
"volume": 588.5256094527075,
"volume_molar": 14.76743358745413,
"formula_full": "Dy16 Ga6 Co2",
"formula_reduced": "Dy8Ga3Co",
"formula_anonymous": "AB3C8",
"energy_above_hull": 1.3096291562500002,
"spacegroup": 186
},
{
"id": "jvasp-121152",
"created_at": "2022-09-04T14:38:54.459007Z",
"updated_at": "2022-09-04T14:38:54.459033Z",
"structure_string": "Rb1 In1 S2\n1.0\n3.789312 -0.000000 -0.000000\n-0.000000 3.789312 0.000000\n-0.000000 0.000000 8.142255\nRb In S\n1 1 2\ndirect\n0.500000 0.500000 0.574689 Rb\n0.000000 0.000000 0.079829 In\n0.000000 0.000000 0.374409 S\n0.500000 0.500000 0.981075 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Rb",
"In",
"S"
],
"chemical_system": "In-Rb-S",
"density": 3.7555285694610783,
"density_atomic": 0.03421326816523335,
"volume": 116.91370671407235,
"volume_molar": 17.601769965137517,
"formula_full": "Rb1 In1 S2",
"formula_reduced": "RbInS2",
"formula_anonymous": "ABC2",
"energy_above_hull": null,
"spacegroup": 99
},
{
"id": "jvasp-122497",
"created_at": "2022-09-04T14:38:54.381742Z",
"updated_at": "2022-09-04T14:38:54.381772Z",
"structure_string": "Cr4 Ga4 N8\n1.0\n5.544077 -0.000000 0.000000\n0.000000 6.530795 0.000000\n0.000000 -0.000000 5.147497\nCr Ga N\n4 4 8\ndirect\n0.577920 0.875188 0.998877 Cr\n0.422081 0.124812 0.498877 Cr\n0.922081 0.375188 0.498877 Cr\n0.077919 0.624813 0.998877 Cr\n0.582278 0.374842 0.003833 Ga\n0.417723 0.625159 0.503833 Ga\n0.917723 0.874842 0.503833 Ga\n0.082277 0.125159 0.003833 Ga\n0.583993 0.376361 0.388497 N\n0.416007 0.623640 0.888497 N\n0.916008 0.876361 0.888497 N\n0.083993 0.123640 0.388497 N\n0.583441 0.873242 0.378795 N\n0.416559 0.126759 0.878795 N\n0.916560 0.373242 0.878795 N\n0.083441 0.626759 0.378795 N\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Cr",
"Ga",
"N"
],
"chemical_system": "Cr-Ga-N",
"density": 5.3362203831989605,
"density_atomic": 0.0858476824606832,
"volume": 186.3766096111882,
"volume_molar": 7.0149136090634014,
"formula_full": "Cr4 Ga4 N8",
"formula_reduced": "CrGaN2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.5724415562500003,
"spacegroup": 33
},
{
"id": "jvasp-121985",
"created_at": "2022-09-04T14:38:54.402238Z",
"updated_at": "2022-09-04T14:38:54.402264Z",
"structure_string": "Pr1 Co12 B6\n1.0\n5.800155 -0.005697 -1.446677\n-1.850520 5.497036 -1.446677\n-0.004098 -0.005697 5.977848\nPr Co B\n1 12 6\ndirect\n0.000000 0.000000 0.000000 Pr\n0.187455 0.458423 0.458423 Co\n0.458423 0.458423 0.187455 Co\n0.458422 0.187455 0.458423 Co\n0.541576 0.541577 0.812544 Co\n0.541576 0.812545 0.541577 Co\n0.812544 0.541577 0.541576 Co\n0.133472 0.500000 0.866527 Co\n0.500000 0.866527 0.133472 Co\n0.866526 0.500000 0.133472 Co\n0.499999 0.133472 0.866527 Co\n0.133473 0.866527 0.500000 Co\n0.866526 0.133472 0.499999 Co\n0.230784 0.230784 0.671210 B\n0.769214 0.328789 0.769215 B\n0.769215 0.769215 0.328789 B\n0.328789 0.769215 0.769215 B\n0.230785 0.671211 0.230784 B\n0.671210 0.230784 0.230784 B\n",
"nsites": 19,
"nelements": 3,
"elements": [
"Pr",
"Co",
"B"
],
"chemical_system": "B-Co-Pr",
"density": 7.960773472895429,
"density_atomic": 0.09977053843103509,
"volume": 190.43697968146648,
"volume_molar": 6.035991039742375,
"formula_full": "Pr1 Co12 B6",
"formula_reduced": "Pr(Co2B)6",
"formula_anonymous": "AB6C12",
"energy_above_hull": 4.493359271052632,
"spacegroup": 166
},
{
"id": "jvasp-120912",
"created_at": "2022-09-04T14:38:54.403646Z",
"updated_at": "2022-09-04T14:38:54.403677Z",
"structure_string": "Li1 H1 Br1\n1.0\n4.676589 0.000000 0.000000\n-0.000000 4.676589 0.000000\n0.000000 0.000000 6.058843\nLi H Br\n1 1 1\ndirect\n0.000000 0.000000 -0.012301 Li\n0.000000 0.000000 0.687262 H\n0.000000 0.000000 0.371660 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"H",
"Br"
],
"chemical_system": "Br-H-Li",
"density": 1.1009238764077782,
"density_atomic": 0.022639829305872893,
"volume": 132.50983297925237,
"volume_molar": 26.59976220950493,
"formula_full": "Li1 H1 Br1",
"formula_reduced": "LiHBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.960358035,
"spacegroup": 99
},
{
"id": "jvasp-121323",
"created_at": "2022-09-04T14:38:54.418893Z",
"updated_at": "2022-09-04T14:38:54.418908Z",
"structure_string": "Mn8 Br4 O12\n1.0\n5.821269 -0.000000 0.000000\n0.000000 6.561633 0.000000\n-0.000000 -0.000000 8.396976\nMn Br O\n8 4 12\ndirect\n0.500000 0.000000 0.500000 Mn\n-0.000000 0.500000 -0.000000 Mn\n0.500000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.684689 0.250000 0.249882 Mn\n0.184689 0.250000 0.250118 Mn\n0.315312 0.750000 0.750118 Mn\n0.815312 0.750000 0.749883 Mn\n0.149438 0.250000 0.545405 Br\n0.649438 0.250000 0.954595 Br\n0.850562 0.750000 0.454595 Br\n0.350562 0.750000 0.045405 Br\n0.937728 0.441211 0.221469 O\n0.676391 0.250000 0.479199 O\n0.176391 0.250000 0.020801 O\n0.323609 0.750000 0.520802 O\n0.823609 0.750000 0.979199 O\n0.937728 0.058789 0.221469 O\n0.437727 0.441211 0.278531 O\n0.062273 0.558789 0.778532 O\n0.562273 0.941210 0.721469 O\n0.062273 0.941210 0.778532 O\n0.562273 0.558789 0.721469 O\n0.437727 0.058789 0.278531 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Mn",
"Br",
"O"
],
"chemical_system": "Br-Mn-O",
"density": 4.924121629707218,
"density_atomic": 0.07482706747627423,
"volume": 320.7395506660714,
"volume_molar": 8.048078005875974,
"formula_full": "Mn8 Br4 O12",
"formula_reduced": "Mn2BrO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.646453181293104,
"spacegroup": 62
},
{
"id": "jvasp-121988",
"created_at": "2022-09-04T14:38:54.420453Z",
"updated_at": "2022-09-04T14:38:54.420480Z",
"structure_string": "Ti6 Si6 Os6\n1.0\n6.245186 -0.002975 -3.985783\n-1.574321 5.633730 -4.546583\n0.007518 0.002975 7.408695\nTi Si Os\n6 6 6\ndirect\n0.445770 0.401719 0.455950 Ti\n0.554231 0.010179 0.955949 Ti\n0.026122 0.006827 0.480705 Ti\n0.973879 0.454583 0.980706 Ti\n0.246892 0.579769 0.832878 Ti\n0.753110 0.585987 0.332879 Ti\n0.338723 0.337370 0.010805 Si\n0.661278 0.672082 0.998648 Si\n0.826566 0.337370 0.498649 Si\n0.173435 0.672082 0.510804 Si\n0.782979 0.025634 0.742656 Si\n0.217022 0.959677 0.242656 Si\n0.000000 0.255875 0.255875 Os\n0.500000 0.255875 0.755876 Os\n0.408931 0.748426 0.411988 Os\n0.591070 0.003058 0.339496 Os\n0.836439 0.748426 0.839496 Os\n0.163562 0.003057 0.911987 Os\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ti",
"Si",
"Os"
],
"chemical_system": "Os-Si-Ti",
"density": 10.164860936658492,
"density_atomic": 0.06899126357390574,
"volume": 260.9025993663357,
"volume_molar": 8.728845433522002,
"formula_full": "Ti6 Si6 Os6",
"formula_reduced": "TiSiOs",
"formula_anonymous": "ABC",
"energy_above_hull": 3.577950644444445,
"spacegroup": 46
},
{
"id": "jvasp-122107",
"created_at": "2022-09-04T14:38:54.423013Z",
"updated_at": "2022-09-04T14:38:54.423038Z",
"structure_string": "Nd1 Zr3 F15\n1.0\n6.857170 -0.004775 -2.872552\n-4.316330 5.328235 -2.872552\n-0.002279 -0.004775 7.434536\nNd Zr F\n1 3 15\ndirect\n0.997995 0.997995 0.997996 Nd\n0.360925 0.793280 0.360926 Zr\n0.360925 0.360924 0.793280 Zr\n0.793279 0.360924 0.360925 Zr\n0.176584 0.417532 0.176584 F\n0.859862 0.640212 0.640213 F\n0.640212 0.640212 0.859863 F\n0.640213 0.859862 0.640213 F\n0.755983 0.096608 0.096609 F\n0.096608 0.096608 0.755984 F\n0.653482 0.110217 0.441106 F\n0.176584 0.176584 0.417532 F\n0.441106 0.653482 0.110218 F\n0.441105 0.110217 0.653482 F\n0.110218 0.441105 0.653482 F\n0.110218 0.653482 0.441106 F\n0.653482 0.441105 0.110218 F\n0.096609 0.755985 0.096609 F\n0.417531 0.176584 0.176584 F\n",
"nsites": 19,
"nelements": 3,
"elements": [
"Nd",
"Zr",
"F"
],
"chemical_system": "F-Nd-Zr",
"density": 4.302298346674749,
"density_atomic": 0.07003540312449273,
"volume": 271.2913634012529,
"volume_molar": 8.59870935460346,
"formula_full": "Nd1 Zr3 F15",
"formula_reduced": "NdZr3F15",
"formula_anonymous": "AB3C15",
"energy_above_hull": null,
"spacegroup": 160
}
]
}