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=density_atomic&page=1117",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=1115",
"results": [
{
"id": "jvasp-58909",
"created_at": "2022-09-04T14:37:01.450221Z",
"updated_at": "2022-09-04T14:37:01.450239Z",
"structure_string": "Zr6 Co1 Cl15\n1.0\n8.347622 -0.000000 -2.951330\n-4.173811 7.229253 -2.951330\n0.000000 0.000000 8.853990\nZr Co Cl\n6 1 15\ndirect\n-0.000000 0.241308 0.241308 Zr\n0.758692 -0.000000 0.758692 Zr\n-0.000000 0.758692 0.758692 Zr\n0.241308 0.241308 -0.000000 Zr\n0.758692 0.758692 -0.000000 Zr\n0.241308 -0.000000 0.241308 Zr\n0.000000 0.000000 0.000000 Co\n0.750595 0.249405 -0.000000 Cl\n0.750595 0.750595 0.501190 Cl\n-0.000000 0.750595 0.249405 Cl\n0.750595 0.000000 0.249405 Cl\n-0.000000 0.249405 0.750595 Cl\n0.249405 0.498810 0.249405 Cl\n0.249405 -0.000000 0.750595 Cl\n0.498810 0.249405 0.249405 Cl\n0.750595 0.501190 0.750595 Cl\n0.501190 0.750595 0.750595 Cl\n-0.000000 0.500000 0.500000 Cl\n0.500000 -0.000000 0.500000 Cl\n0.500000 0.500000 -0.000000 Cl\n0.249405 0.249405 0.498810 Cl\n0.249405 0.750595 -0.000000 Cl\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Zr",
"Co",
"Cl"
],
"chemical_system": "Cl-Co-Zr",
"density": 3.5369073571891763,
"density_atomic": 0.04117441664441492,
"volume": 534.3123665841706,
"volume_molar": 14.625928551720891,
"formula_full": "Zr6 Co1 Cl15",
"formula_reduced": "Zr6CoCl15",
"formula_anonymous": "AB6C15",
"energy_above_hull": 1.688776314204546,
"spacegroup": 229
},
{
"id": "jvasp-40201",
"created_at": "2022-09-04T14:38:29.566388Z",
"updated_at": "2022-09-04T14:38:29.566416Z",
"structure_string": "Ca2 Sn2 S6\n1.0\n0.000000 0.000000 -6.315966\n-3.331712 -5.770714 0.000000\n-3.331712 5.770714 -0.000000\nCa Sn S\n2 2 6\ndirect\n0.250000 0.666729 0.333271 Ca\n0.750000 0.333271 0.666729 Ca\n0.000000 0.000000 0.000000 Sn\n0.500000 0.000000 0.000000 Sn\n0.250000 0.174295 0.825705 S\n0.250000 0.651414 0.825730 S\n0.250000 0.174269 0.348586 S\n0.750000 0.825705 0.174295 S\n0.750000 0.348586 0.174269 S\n0.750000 0.825730 0.651414 S\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ca",
"Sn",
"S"
],
"chemical_system": "Ca-S-Sn",
"density": 3.4867718933553955,
"density_atomic": 0.04117496293292945,
"volume": 242.86603527219097,
"volume_molar": 14.62573450232259,
"formula_full": "Ca2 Sn2 S6",
"formula_reduced": "CaSnS3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.046536424,
"spacegroup": 194
},
{
"id": "jvasp-101020",
"created_at": "2022-09-04T14:37:08.403435Z",
"updated_at": "2022-09-04T14:37:08.403458Z",
"structure_string": "Sr1 Li2 In1\n1.0\n4.468599 -0.000000 2.579947\n1.489533 4.213036 2.579947\n-0.000000 -0.000000 5.159894\nSr Li In\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Sr\n0.250000 0.250000 0.250000 Li\n0.749999 0.750001 0.750000 Li\n0.500000 0.500001 0.500000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"Li",
"In"
],
"chemical_system": "In-Li-Sr",
"density": 3.6977575936576774,
"density_atomic": 0.04117680608923984,
"volume": 97.14206564081385,
"volume_molar": 14.625079825153517,
"formula_full": "Sr1 Li2 In1",
"formula_reduced": "SrLi2In",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.15844624625,
"spacegroup": 225
},
{
"id": "jvasp-2559",
"created_at": "2022-09-04T14:36:47.915806Z",
"updated_at": "2022-09-04T14:36:47.915826Z",
"structure_string": "K2 Cu2 Se2\n1.0\n2.100618 -3.638376 0.000000\n2.100618 3.638376 0.000000\n0.000000 0.000000 9.532153\nK Cu Se\n2 2 2\ndirect\n0.000000 0.000000 0.000000 K\n0.000000 0.000000 0.500000 K\n0.333333 0.666668 0.750000 Cu\n0.666668 0.333333 0.250000 Cu\n0.333333 0.666668 0.250000 Se\n0.666668 0.333333 0.750000 Se\n",
"nsites": 6,
"nelements": 3,
"elements": [
"K",
"Cu",
"Se"
],
"chemical_system": "Cu-K-Se",
"density": 4.13932531501447,
"density_atomic": 0.04117898041025944,
"volume": 145.70540455890315,
"volume_molar": 14.624307595774344,
"formula_full": "K2 Cu2 Se2",
"formula_reduced": "KCuSe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-41174",
"created_at": "2022-09-04T14:37:40.487299Z",
"updated_at": "2022-09-04T14:37:40.487314Z",
"structure_string": "Nd1 Mg1 Hg2\n1.0\n0.000000 3.648471 3.648471\n3.648471 0.000000 3.648471\n3.648471 3.648471 0.000000\nNd Mg Hg\n1 1 2\ndirect\n0.749999 0.749999 0.749999 Nd\n0.250000 0.250000 0.250000 Mg\n0.000000 0.000000 0.000000 Hg\n0.500001 0.500001 0.500001 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Nd",
"Mg",
"Hg"
],
"chemical_system": "Hg-Mg-Nd",
"density": 9.739871061971622,
"density_atomic": 0.04118103901673164,
"volume": 97.13208057656877,
"volume_molar": 14.623576538593978,
"formula_full": "Nd1 Mg1 Hg2",
"formula_reduced": "NdMgHg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-11432",
"created_at": "2022-09-04T14:37:18.640581Z",
"updated_at": "2022-09-04T14:37:18.640602Z",
"structure_string": "Li4 Ca4 Sb4\n1.0\n4.619280 0.000000 0.000000\n0.000000 7.626611 0.000000\n0.000000 0.000000 8.271256\nLi Ca Sb\n4 4 4\ndirect\n0.750000 0.847548 0.427132 Li\n0.250000 0.152452 0.572868 Li\n0.250000 0.652452 0.927132 Li\n0.750000 0.347548 0.072868 Li\n0.750000 0.490577 0.703234 Ca\n0.750000 0.990577 0.796767 Ca\n0.250000 0.509422 0.296766 Ca\n0.250000 0.009422 0.203234 Ca\n0.750000 0.731110 0.098875 Sb\n0.250000 0.268890 0.901125 Sb\n0.750000 0.231110 0.401125 Sb\n0.250000 0.768890 0.598876 Sb\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Li",
"Ca",
"Sb"
],
"chemical_system": "Ca-Li-Sb",
"density": 3.8472477291951823,
"density_atomic": 0.04118166484896287,
"volume": 291.3918134201466,
"volume_molar": 14.623354306064833,
"formula_full": "Li4 Ca4 Sb4",
"formula_reduced": "LiCaSb",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2108355066666668,
"spacegroup": 62
},
{
"id": "jvasp-76204",
"created_at": "2022-09-04T14:35:58.712469Z",
"updated_at": "2022-09-04T14:35:58.712485Z",
"structure_string": "Nd2 Sc2 Si2\n1.0\n4.293282 -0.000000 0.000000\n-0.000000 4.293282 0.000000\n-2.146642 -2.146642 7.904008\nNd Sc Si\n2 2 2\ndirect\n0.676415 0.676415 0.352831 Nd\n0.323585 0.323585 0.647169 Nd\n0.500000 -0.000000 -0.000000 Sc\n-0.000000 0.500000 -0.000000 Sc\n0.877278 0.877278 0.754557 Si\n0.122722 0.122722 0.245444 Si\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Nd",
"Sc",
"Si"
],
"chemical_system": "Nd-Sc-Si",
"density": 4.95312699450851,
"density_atomic": 0.04118367025651374,
"volume": 145.68881215852832,
"volume_molar": 14.62264223293095,
"formula_full": "Nd2 Sc2 Si2",
"formula_reduced": "NdScSi",
"formula_anonymous": "ABC",
"energy_above_hull": 1.9728751166666665,
"spacegroup": 139
},
{
"id": "jvasp-90046",
"created_at": "2022-09-04T14:35:57.237479Z",
"updated_at": "2022-09-04T14:35:57.237496Z",
"structure_string": "Ce3 Mg3 Ag3\n1.0\n0.000000 0.000000 -4.456781\n-3.762224 -6.516364 0.000000\n-3.762069 6.516274 0.000000\nCe Mg Ag\n3 3 3\ndirect\n0.500000 0.578656 -0.000000 Ce\n0.500000 0.421319 0.421327 Ce\n0.500000 0.999993 0.578673 Ce\n0.000000 0.239237 -0.000000 Mg\n0.000000 0.760735 0.760752 Mg\n0.000000 0.999982 0.239247 Mg\n0.000000 0.333322 0.666664 Ag\n0.000000 0.666657 0.333336 Ag\n0.500000 0.999993 -0.000000 Ag\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Ce",
"Mg",
"Ag"
],
"chemical_system": "Ag-Ce-Mg",
"density": 6.207424396076249,
"density_atomic": 0.04118633807343175,
"volume": 218.51906289784156,
"volume_molar": 14.621695061267728,
"formula_full": "Ce3 Mg3 Ag3",
"formula_reduced": "CeMgAg",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2616906033333334,
"spacegroup": 189
},
{
"id": "jvasp-36055",
"created_at": "2022-09-04T14:38:13.088497Z",
"updated_at": "2022-09-04T14:38:13.088515Z",
"structure_string": "Tm1 Np3\n1.0\n4.596584 0.000000 0.000000\n-0.000000 4.596584 0.000000\n-0.000000 0.000000 4.596584\nTm Np\n1 3\ndirect\n0.000000 0.000000 0.000000 Tm\n0.000000 0.500000 0.500000 Np\n0.500000 0.000000 0.500000 Np\n0.500000 0.500000 0.000000 Np\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Tm",
"Np"
],
"chemical_system": "Np-Tm",
"density": 15.045052131207234,
"density_atomic": 0.04118645265853617,
"volume": 97.1193133131113,
"volume_molar": 14.621654382152455,
"formula_full": "Tm1 Np3",
"formula_reduced": "TmNp3",
"formula_anonymous": "AB3",
"energy_above_hull": 5.784121062500001,
"spacegroup": 221
},
{
"id": "jvasp-99089",
"created_at": "2022-09-04T14:36:12.676182Z",
"updated_at": "2022-09-04T14:36:12.676212Z",
"structure_string": "K4 Mn2 P4 S12\n1.0\n6.186849 -0.040605 0.000000\n-1.527301 7.119927 0.000000\n0.000000 0.000000 12.142968\nK Mn P S\n4 2 4 12\ndirect\n0.778698 0.466923 0.688834 K\n0.721303 0.033078 0.188834 K\n0.221303 0.533078 0.311166 K\n0.278698 0.966923 0.811166 K\n0.500000 0.500001 0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.484963 0.138683 0.463999 P\n0.015037 0.361318 0.963999 P\n0.515038 0.861318 0.536002 P\n0.984963 0.638684 0.036001 P\n0.784049 0.572353 0.170038 S\n0.715952 0.927649 0.670038 S\n0.179483 0.242047 0.079987 S\n0.320518 0.257953 0.579987 S\n0.820518 0.757954 0.920014 S\n0.806835 0.265304 0.436370 S\n0.306835 0.765304 0.063630 S\n0.193166 0.734697 0.563630 S\n0.693166 0.234697 0.936370 S\n0.284049 0.072352 0.329962 S\n0.679483 0.742048 0.420014 S\n0.215951 0.427648 0.829962 S\n",
"nsites": 22,
"nelements": 4,
"elements": [
"K",
"Mn",
"P",
"S"
],
"chemical_system": "K-Mn-P-S",
"density": 2.4091373191104775,
"density_atomic": 0.04118742385327977,
"volume": 534.1436278794633,
"volume_molar": 14.621309605214494,
"formula_full": "K4 Mn2 P4 S12",
"formula_reduced": "K2Mn(PS3)2",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 2.0985894764890283,
"spacegroup": 14
},
{
"id": "jvasp-113658",
"created_at": "2022-09-04T14:38:50.797638Z",
"updated_at": "2022-09-04T14:38:50.797666Z",
"structure_string": "Li2 Bi1\n1.0\n4.786423 0.000000 -1.236963\n0.000000 3.443124 0.000000\n-1.316887 0.000000 4.759293\nLi Bi\n2 1\ndirect\n-0.199768 0.000000 -0.199608 Li\n0.133078 0.000000 0.466274 Li\n0.466690 0.000000 0.133333 Bi\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"Bi"
],
"chemical_system": "Bi-Li",
"density": 5.0816099402769686,
"density_atomic": 0.041194257566559304,
"volume": 72.82568438459592,
"volume_molar": 14.618884076912352,
"formula_full": "Li2 Bi1",
"formula_reduced": "Li2Bi",
"formula_anonymous": "AB2",
"energy_above_hull": 0.5280981,
"spacegroup": 191
},
{
"id": "jvasp-15710",
"created_at": "2022-09-04T14:36:35.346699Z",
"updated_at": "2022-09-04T14:36:35.346726Z",
"structure_string": "Sr1 Sb2 Pd2\n1.0\n4.367646 -0.000000 -1.716210\n-0.674363 4.315271 -1.716210\n0.006907 0.008069 6.433372\nSr Sb Pd\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.367857 0.367856 0.735711 Sb\n0.632145 0.632144 0.264290 Sb\n0.250001 0.750000 0.500000 Pd\n0.750001 0.250000 0.500000 Pd\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"Sb",
"Pd"
],
"chemical_system": "Pd-Sb-Sr",
"density": 7.442258983521413,
"density_atomic": 0.04119483362129924,
"volume": 121.37444335774224,
"volume_molar": 14.618679651339415,
"formula_full": "Sr1 Sb2 Pd2",
"formula_reduced": "Sr(SbPd)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.1277319820000002,
"spacegroup": 139
}
]
}