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=created_at&page=348",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=created_at&page=346",
"results": [
{
"id": "jvasp-5176",
"created_at": "2022-09-04T14:35:52.151133Z",
"updated_at": "2022-09-04T14:35:52.151158Z",
"structure_string": "Cu2 Br2\n1.0\n3.895575 0.000000 0.000000\n0.000000 3.895575 0.000000\n0.000000 0.000000 5.818320\nCu Br\n2 2\ndirect\n0.499999 0.499999 0.000000 Cu\n0.000000 0.000000 0.000000 Cu\n0.499999 0.000000 0.277828 Br\n0.000000 0.499999 0.722172 Br\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cu",
"Br"
],
"chemical_system": "Br-Cu",
"density": 5.395589518988105,
"density_atomic": 0.045302195298370096,
"volume": 88.29594181154205,
"volume_molar": 13.293264753146891,
"formula_full": "Cu2 Br2",
"formula_reduced": "CuBr",
"formula_anonymous": "AB",
"energy_above_hull": 0.00886,
"spacegroup": 129
},
{
"id": "jvasp-88474",
"created_at": "2022-09-04T14:35:52.155450Z",
"updated_at": "2022-09-04T14:35:52.155484Z",
"structure_string": "K8 U2 P4 O20\n1.0\n6.904584 0.000000 0.000000\n0.000000 6.904584 0.000000\n-0.000000 -0.000000 11.903618\nK U P O\n8 2 4 20\ndirect\n0.750000 0.502195 0.921515 K\n0.250000 0.497805 0.078485 K\n0.750000 0.997804 0.921515 K\n0.002195 0.250000 0.578485 K\n0.250000 0.002195 0.078485 K\n0.497805 0.250000 0.578485 K\n0.997804 0.750000 0.421515 K\n0.502195 0.750000 0.421515 K\n0.750000 0.250000 0.250000 U\n0.250000 0.750000 0.750000 U\n0.750000 0.750000 0.168990 P\n0.250000 0.250000 0.331010 P\n0.250000 0.250000 0.831010 P\n0.750000 0.750000 0.668990 P\n0.750000 0.250000 0.093717 O\n0.250000 0.750000 0.906284 O\n0.065181 0.250000 0.901715 O\n0.250000 0.065181 0.401714 O\n0.074254 0.250000 0.245203 O\n0.250000 0.425746 0.745203 O\n0.425746 0.250000 0.245203 O\n0.934818 0.750000 0.098286 O\n0.250000 0.434818 0.401714 O\n0.925746 0.750000 0.754797 O\n0.250000 0.750000 0.593717 O\n0.250000 0.074254 0.745203 O\n0.750000 0.250000 0.406284 O\n0.434818 0.250000 0.901715 O\n0.750000 0.925746 0.254797 O\n0.750000 0.565181 0.598286 O\n0.750000 0.574253 0.254797 O\n0.565181 0.750000 0.098286 O\n0.574253 0.750000 0.754797 O\n0.750000 0.934818 0.598286 O\n",
"nsites": 34,
"nelements": 4,
"elements": [
"K",
"U",
"P",
"O"
],
"chemical_system": "K-O-P-U",
"density": 3.6071324020166675,
"density_atomic": 0.05991352893979123,
"volume": 567.4845164631772,
"volume_molar": 10.051387168417032,
"formula_full": "K8 U2 P4 O20",
"formula_reduced": "K4U(PO5)2",
"formula_anonymous": "AB2C4D10",
"energy_above_hull": 2.2259172941176475,
"spacegroup": 137
},
{
"id": "jvasp-98069",
"created_at": "2022-09-04T14:35:52.159530Z",
"updated_at": "2022-09-04T14:35:52.159549Z",
"structure_string": "La4 S4\n1.0\n-2.939403 -2.939362 0.000000\n-2.939403 2.939362 -0.000000\n0.000000 -0.000000 -11.768991\nLa S\n4 4\ndirect\n0.252023 0.747976 0.375004 La\n0.747976 0.252023 0.624996 La\n0.247977 0.752022 0.875004 La\n0.752022 0.247977 0.124996 La\n0.751866 0.248133 0.374997 S\n0.248133 0.751866 0.625003 S\n0.748133 0.251866 0.874997 S\n0.251866 0.748133 0.125003 S\n",
"nsites": 8,
"nelements": 2,
"elements": [
"La",
"S"
],
"chemical_system": "La-S",
"density": 5.58404307246199,
"density_atomic": 0.03933766270150636,
"volume": 203.367446121644,
"volume_molar": 15.308842331828203,
"formula_full": "La4 S4",
"formula_reduced": "LaS",
"formula_anonymous": "AB",
"energy_above_hull": 0.0820824999999998,
"spacegroup": 225
},
{
"id": "jvasp-74946",
"created_at": "2022-09-04T14:35:52.161238Z",
"updated_at": "2022-09-04T14:35:52.161266Z",
"structure_string": "Be1 Pd2 W1\n1.0\n4.594943 0.000000 0.000000\n0.000000 4.594943 0.000000\n0.000000 -0.000000 2.732351\nBe Pd W\n1 2 1\ndirect\n0.000000 0.000000 0.500000 Be\n0.500000 0.000000 0.000000 Pd\n0.000000 0.500000 0.000000 Pd\n0.500000 0.500000 0.500000 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Pd",
"W"
],
"chemical_system": "Be-Pd-W",
"density": 11.677476203098134,
"density_atomic": 0.06933671247419756,
"volume": 57.68949604422807,
"volume_molar": 8.685356638795115,
"formula_full": "Be1 Pd2 W1",
"formula_reduced": "BePd2W",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.294834375,
"spacegroup": 123
},
{
"id": "jvasp-92251",
"created_at": "2022-09-04T14:35:52.164347Z",
"updated_at": "2022-09-04T14:35:52.164377Z",
"structure_string": "Li2 Bi1 F5\n1.0\n1.994541 4.400553 0.003758\n-3.549467 4.283856 0.001758\n-0.995345 -2.195753 4.998711\nLi Bi F\n2 1 5\ndirect\n0.232682 0.499255 0.498970 Li\n0.733054 0.500305 0.500787 Li\n0.024906 -0.000319 -0.000315 Bi\n0.921443 0.746789 0.624218 F\n0.297879 0.624594 0.253093 F\n0.668423 0.375741 0.747179 F\n0.044980 0.252697 0.375432 F\n0.576619 0.000953 0.000637 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Li",
"Bi",
"F"
],
"chemical_system": "Bi-F-Li",
"density": 4.368060134010702,
"density_atomic": 0.06620659436550949,
"volume": 120.8338848519238,
"volume_molar": 9.09598328944896,
"formula_full": "Li2 Bi1 F5",
"formula_reduced": "Li2BiF5",
"formula_anonymous": "AB2C5",
"energy_above_hull": 0.0873250353124999,
"spacegroup": 79
},
{
"id": "jvasp-86482",
"created_at": "2022-09-04T14:35:52.165202Z",
"updated_at": "2022-09-04T14:35:52.165219Z",
"structure_string": "Li1 Pr2 Ge6\n1.0\n4.081157 0.000000 -0.800024\n0.000000 4.289706 0.000000\n0.041600 0.000000 11.021803\nLi Pr Ge\n1 2 6\ndirect\n0.000000 0.000000 0.000000 Li\n0.833589 0.000000 0.667175 Pr\n0.166412 0.000000 0.332825 Pr\n0.287213 0.500000 0.574425 Ge\n0.712788 0.500000 0.425575 Ge\n0.438877 0.000000 0.877752 Ge\n0.938657 0.500000 0.877311 Ge\n0.061344 0.500000 0.122689 Ge\n0.561124 0.000000 0.122248 Ge\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Li",
"Pr",
"Ge"
],
"chemical_system": "Ge-Li-Pr",
"density": 6.231039844565996,
"density_atomic": 0.0466077167856105,
"volume": 193.10107039567808,
"volume_molar": 12.920909186993804,
"formula_full": "Li1 Pr2 Ge6",
"formula_reduced": "Li(PrGe3)2",
"formula_anonymous": "AB2C6",
"energy_above_hull": 1.1177417111111112,
"spacegroup": 65
},
{
"id": "jvasp-56962",
"created_at": "2022-09-04T14:35:52.169940Z",
"updated_at": "2022-09-04T14:35:52.169960Z",
"structure_string": "Cr1 Ga1 Co2\n1.0\n3.496442 -0.000000 2.018671\n1.165481 3.296477 2.018671\n0.000000 0.000000 4.037344\nCr Ga Co\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Cr\n0.499999 0.500000 0.499999 Ga\n0.250000 0.250000 0.250000 Co\n0.749999 0.750001 0.749999 Co\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Cr",
"Ga",
"Co"
],
"chemical_system": "Co-Cr-Ga",
"density": 8.549436216816384,
"density_atomic": 0.08595830796615032,
"volume": 46.53418726640324,
"volume_molar": 7.005885646761997,
"formula_full": "Cr1 Ga1 Co2",
"formula_reduced": "CrGaCo2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.70301288125,
"spacegroup": 225
},
{
"id": "jvasp-61588",
"created_at": "2022-09-04T14:35:52.176355Z",
"updated_at": "2022-09-04T14:35:52.176373Z",
"structure_string": "Y12 Sc8 Al12 O48\n1.0\n-6.200181 6.200181 6.200181\n6.200181 -6.200181 6.200181\n6.200181 6.200181 -6.200181\nY Sc Al O\n12 8 12 48\ndirect\n0.875000 0.625000 0.250000 Y\n0.250000 0.375000 0.125000 Y\n0.125000 0.250000 0.375000 Y\n0.375000 0.750000 0.125000 Y\n0.375000 0.125000 0.250000 Y\n0.750000 0.125000 0.375000 Y\n0.750000 0.625000 0.875000 Y\n0.250000 0.875000 0.625000 Y\n0.875000 0.750000 0.625000 Y\n0.625000 0.250000 0.875000 Y\n0.125000 0.375000 0.750000 Y\n0.625000 0.875000 0.750000 Y\n0.000000 0.000000 0.000000 Sc\n0.000000 0.000000 0.500000 Sc\n0.500000 0.000000 0.000000 Sc\n0.500000 0.500000 0.500000 Sc\n0.000000 0.500000 0.000000 Sc\n0.000000 0.500000 0.500000 Sc\n0.500000 0.000000 0.500000 Sc\n0.500000 0.500000 0.000000 Sc\n0.250000 0.625000 0.375000 Al\n0.125000 0.875000 0.250000 Al\n0.750000 0.875000 0.125000 Al\n0.375000 0.250000 0.625000 Al\n0.125000 0.750000 0.875000 Al\n0.625000 0.375000 0.250000 Al\n0.875000 0.125000 0.750000 Al\n0.250000 0.125000 0.875000 Al\n0.750000 0.375000 0.625000 Al\n0.375000 0.625000 0.750000 Al\n0.625000 0.750000 0.375000 Al\n0.875000 0.250000 0.125000 Al\n0.286079 0.474017 0.374567 O\n0.125433 0.599450 0.911514 O\n0.187938 0.213921 0.588486 O\n0.099450 0.625433 0.411514 O\n0.312062 0.900550 0.025983 O\n0.900550 0.025983 0.312062 O\n0.374567 0.286079 0.474017 O\n0.599450 0.911514 0.125433 O\n0.525983 0.400550 0.812062 O\n0.812062 0.525983 0.400550 O\n0.625433 0.411514 0.099450 O\n0.687938 0.088486 0.713921 O\n0.974017 0.786079 0.874567 O\n0.025983 0.312062 0.900550 O\n0.411514 0.099450 0.625433 O\n0.088486 0.713921 0.687938 O\n0.213921 0.588486 0.187938 O\n0.713921 0.687938 0.088486 O\n0.474017 0.374567 0.286079 O\n0.911514 0.125433 0.599450 O\n0.400550 0.812062 0.525983 O\n0.786079 0.874567 0.974017 O\n0.088486 0.874567 0.400550 O\n0.411514 0.812062 0.786079 O\n0.525983 0.625433 0.713921 O\n0.974017 0.687938 0.099450 O\n0.687938 0.099450 0.974017 O\n0.625433 0.713921 0.525983 O\n0.812062 0.786079 0.411514 O\n0.874567 0.400550 0.088486 O\n0.713921 0.525983 0.625433 O\n0.099450 0.974017 0.687938 O\n0.588486 0.187938 0.213921 O\n0.400550 0.088486 0.874567 O\n0.911514 0.286079 0.312062 O\n0.588486 0.900550 0.374567 O\n0.474017 0.599450 0.187938 O\n0.874567 0.974017 0.786079 O\n0.312062 0.911514 0.286079 O\n0.374567 0.588486 0.900550 O\n0.187938 0.474017 0.599450 O\n0.125433 0.025983 0.213921 O\n0.286079 0.312062 0.911514 O\n0.900550 0.374567 0.588486 O\n0.599450 0.187938 0.474017 O\n0.213921 0.125433 0.025983 O\n0.786079 0.411514 0.812062 O\n0.025983 0.213921 0.125433 O\n",
"nsites": 80,
"nelements": 4,
"elements": [
"Y",
"Sc",
"Al",
"O"
],
"chemical_system": "Al-O-Sc-Y",
"density": 4.386092680098496,
"density_atomic": 0.083910612640409,
"volume": 953.3954941174419,
"volume_molar": 7.176852331906233,
"formula_full": "Y12 Sc8 Al12 O48",
"formula_reduced": "Y3Sc2Al3O12",
"formula_anonymous": "A2B3C3D12",
"energy_above_hull": 2.8454583625,
"spacegroup": 230
},
{
"id": "jvasp-68887",
"created_at": "2022-09-04T14:35:52.176838Z",
"updated_at": "2022-09-04T14:35:52.176859Z",
"structure_string": "Sr2 Ca1 Be1\n1.0\n3.783557 0.000000 -0.000000\n-0.000000 3.783557 -0.000000\n0.000000 0.000000 9.950159\nSr Ca Be\n2 1 1\ndirect\n0.000000 0.000000 0.984091 Sr\n0.500000 0.500000 0.326341 Sr\n0.500000 0.500000 0.672308 Ca\n0.000000 0.000000 0.517260 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Ca",
"Be"
],
"chemical_system": "Be-Ca-Sr",
"density": 2.6152079230694243,
"density_atomic": 0.028082088811097018,
"volume": 142.43954667714553,
"volume_molar": 21.444774997009016,
"formula_full": "Sr2 Ca1 Be1",
"formula_reduced": "Sr2CaBe",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1222422849999999,
"spacegroup": 99
},
{
"id": "jvasp-70822",
"created_at": "2022-09-04T14:35:52.177936Z",
"updated_at": "2022-09-04T14:35:52.177956Z",
"structure_string": "Be1 Tc2 Pt1\n1.0\n2.795043 0.000000 -0.000000\n-0.000000 2.795043 0.000000\n0.000000 0.000000 6.713831\nBe Tc Pt\n1 2 1\ndirect\n0.000000 0.000000 0.504217 Be\n0.000000 0.000000 0.015629 Tc\n0.500000 0.500000 0.272651 Tc\n0.500000 0.500000 0.707502 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Tc",
"Pt"
],
"chemical_system": "Be-Pt-Tc",
"density": 12.666776633412518,
"density_atomic": 0.0762627741228985,
"volume": 52.450229433746344,
"volume_molar": 7.896566613607889,
"formula_full": "Be1 Tc2 Pt1",
"formula_reduced": "BeTc2Pt",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.778627625,
"spacegroup": 99
},
{
"id": "jvasp-65152",
"created_at": "2022-09-04T14:35:52.178168Z",
"updated_at": "2022-09-04T14:35:52.178187Z",
"structure_string": "Be1 Cr4 Se1\n1.0\n0.000000 3.364750 3.364750\n3.364750 -0.000000 3.364750\n3.364750 3.364750 0.000000\nBe Cr Se\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.120198 0.626600 0.626600 Cr\n0.626600 0.626600 0.626600 Cr\n0.626600 0.120198 0.626600 Cr\n0.626600 0.626600 0.120198 Cr\n0.250000 0.250000 0.250000 Se\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Cr",
"Se"
],
"chemical_system": "Be-Cr-Se",
"density": 6.4504304869643905,
"density_atomic": 0.07875222799103494,
"volume": 76.18832067434374,
"volume_molar": 7.646946522815269,
"formula_full": "Be1 Cr4 Se1",
"formula_reduced": "BeCr4Se",
"formula_anonymous": "ABC4",
"energy_above_hull": 4.234966511111111,
"spacegroup": 216
},
{
"id": "jvasp-71474",
"created_at": "2022-09-04T14:35:52.183684Z",
"updated_at": "2022-09-04T14:35:52.183709Z",
"structure_string": "Be2 V1 Br1\n1.0\n3.182715 0.000000 -0.000000\n0.000000 3.182715 0.000000\n-0.000000 0.000000 5.686867\nBe V Br\n2 1 1\ndirect\n0.000000 0.000000 0.672702 Be\n0.000000 0.000000 0.327298 Be\n0.499999 0.499999 0.500000 V\n0.499999 0.499999 0.000000 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"V",
"Br"
],
"chemical_system": "Be-Br-V",
"density": 4.29128457688096,
"density_atomic": 0.06943707498013131,
"volume": 57.606113177212,
"volume_molar": 8.672803054741538,
"formula_full": "Be2 V1 Br1",
"formula_reduced": "Be2VBr",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.09808262625,
"spacegroup": 123
}
]
}