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=446",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=444",
"results": [
{
"id": "jvasp-20657",
"created_at": "2022-09-04T14:38:10.626649Z",
"updated_at": "2022-09-04T14:38:10.626676Z",
"structure_string": "Nd2 Rh4\n1.0\n4.682751 -0.000000 2.703587\n1.560917 4.414940 2.703587\n0.000000 0.000000 5.407175\nNd Rh\n2 4\ndirect\n0.125000 0.125000 0.125000 Nd\n0.875000 0.875000 0.875002 Nd\n0.500000 -0.000000 0.500001 Rh\n0.000000 0.500000 0.500001 Rh\n0.500000 0.500000 0.500001 Rh\n0.500000 0.500000 0.000000 Rh\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Nd",
"Rh"
],
"chemical_system": "Nd-Rh",
"density": 10.399599166449669,
"density_atomic": 0.053672886719652244,
"volume": 111.78828579389804,
"volume_molar": 11.220079872832706,
"formula_full": "Nd2 Rh4",
"formula_reduced": "NdRh2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.9655725,
"spacegroup": 227
},
{
"id": "jvasp-15848",
"created_at": "2022-09-04T14:38:30.303764Z",
"updated_at": "2022-09-04T14:38:30.303804Z",
"structure_string": "Sc2 Te2\n1.0\n2.069984 -3.585318 -0.000000\n2.069984 3.585318 -0.000000\n-0.000000 0.000000 6.914479\nSc Te\n2 2\ndirect\n0.000000 0.000000 0.000000 Sc\n0.000000 0.000000 0.500000 Sc\n0.333332 0.666666 0.750000 Te\n0.666666 0.333332 0.250000 Te\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sc",
"Te"
],
"chemical_system": "Sc-Te",
"density": 5.583735128963181,
"density_atomic": 0.038974079224586025,
"volume": 102.63231562060045,
"volume_molar": 15.451656279800066,
"formula_full": "Sc2 Te2",
"formula_reduced": "ScTe",
"formula_anonymous": "AB",
"energy_above_hull": 0.5578165083333335,
"spacegroup": 194
},
{
"id": "jvasp-43398",
"created_at": "2022-09-04T14:38:28.444116Z",
"updated_at": "2022-09-04T14:38:28.444136Z",
"structure_string": "Zr3 O6\n1.0\n5.449486 -0.024381 -0.005779\n-1.955834 5.086788 -0.014232\n-1.714156 -2.475612 4.915448\nZr O\n3 6\ndirect\n0.810109 0.671292 0.980666 Zr\n0.174325 0.307029 0.980634 Zr\n0.992221 0.489164 0.480651 Zr\n0.168462 0.665392 0.251257 O\n0.026660 0.863680 0.767309 O\n0.617717 0.454857 0.194076 O\n0.957775 0.114638 0.193992 O\n0.366715 0.523474 0.767230 O\n0.815971 0.312926 0.710039 O\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Zr",
"O"
],
"chemical_system": "O-Zr",
"density": 4.521815831217735,
"density_atomic": 0.06629701184147753,
"volume": 135.7527247460241,
"volume_molar": 9.083577966378806,
"formula_full": "Zr3 O6",
"formula_reduced": "ZrO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.514403833333334,
"spacegroup": 12
},
{
"id": "jvasp-108651",
"created_at": "2022-09-04T14:38:18.750510Z",
"updated_at": "2022-09-04T14:38:18.750536Z",
"structure_string": "Mg5 Ge1\n1.0\n4.807198 0.013711 3.519308\n1.792673 4.460455 3.519308\n0.020225 0.013711 5.957707\nMg Ge\n5 1\ndirect\n0.160934 0.839065 0.500001 Mg\n0.499999 0.160935 0.839066 Mg\n0.839064 0.500000 0.160936 Mg\n0.332934 0.332934 0.332935 Mg\n0.667065 0.667066 0.667067 Mg\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"Ge"
],
"chemical_system": "Ge-Mg",
"density": 2.535963763717581,
"density_atomic": 0.04719263745570305,
"volume": 127.13847590382815,
"volume_molar": 12.760763298412023,
"formula_full": "Mg5 Ge1",
"formula_reduced": "Mg5Ge",
"formula_anonymous": "AB5",
"energy_above_hull": 0.0,
"spacegroup": 155
},
{
"id": "jvasp-38622",
"created_at": "2022-09-04T14:38:28.418569Z",
"updated_at": "2022-09-04T14:38:28.418588Z",
"structure_string": "Nd6 Zr2\n1.0\n3.547835 -6.145030 -0.000000\n3.547835 6.145030 -0.000000\n0.000000 -0.000000 5.729344\nNd Zr\n6 2\ndirect\n0.656978 0.828488 0.749999 Nd\n0.171510 0.343020 0.749999 Nd\n0.171510 0.828489 0.749999 Nd\n0.343020 0.171510 0.250000 Nd\n0.828488 0.656978 0.250000 Nd\n0.828489 0.171510 0.250000 Nd\n0.333332 0.666666 0.250000 Zr\n0.666666 0.333332 0.749999 Zr\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Nd",
"Zr"
],
"chemical_system": "Nd-Zr",
"density": 6.9654089893791395,
"density_atomic": 0.03202341704323419,
"volume": 249.81718812827984,
"volume_molar": 18.805428389698776,
"formula_full": "Nd6 Zr2",
"formula_reduced": "Nd3Zr",
"formula_anonymous": "AB3",
"energy_above_hull": 2.3380922500000003,
"spacegroup": 194
},
{
"id": "jvasp-18345",
"created_at": "2022-09-04T14:38:12.446031Z",
"updated_at": "2022-09-04T14:38:12.446055Z",
"structure_string": "Ba1 Bi3\n1.0\n5.168373 -0.000000 -0.000000\n0.000000 5.168373 0.000000\n0.000000 0.000000 5.168373\nBa Bi\n1 3\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.000000 Bi\n0.000000 0.500000 0.500000 Bi\n0.500000 0.000000 0.500000 Bi\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ba",
"Bi"
],
"chemical_system": "Ba-Bi",
"density": 9.192493681662498,
"density_atomic": 0.02897333208709346,
"volume": 138.0579902917639,
"volume_molar": 20.785116264492892,
"formula_full": "Ba1 Bi3",
"formula_reduced": "BaBi3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.5450739375,
"spacegroup": 221
},
{
"id": "jvasp-37736",
"created_at": "2022-09-04T14:38:18.774643Z",
"updated_at": "2022-09-04T14:38:18.774662Z",
"structure_string": "K3 In1\n1.0\n-2.869603 2.869603 5.554818\n2.869603 -2.869603 5.554818\n2.869603 2.869603 -5.554818\nK In\n3 1\ndirect\n0.750000 0.250000 0.499999 K\n0.250000 0.750000 0.499999 K\n0.500000 0.500000 0.000000 K\n0.000000 0.000000 0.000000 In\n",
"nsites": 4,
"nelements": 2,
"elements": [
"K",
"In"
],
"chemical_system": "In-K",
"density": 2.1065652426972403,
"density_atomic": 0.021861830886659665,
"volume": 182.9672922061091,
"volume_molar": 27.546369703531,
"formula_full": "K3 In1",
"formula_reduced": "K3In",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0022524999999999,
"spacegroup": 139
},
{
"id": "jvasp-20339",
"created_at": "2022-09-04T14:38:28.411218Z",
"updated_at": "2022-09-04T14:38:28.411245Z",
"structure_string": "Ho16 O24\n1.0\n8.640066 0.000000 -3.054725\n-4.320033 7.482517 -3.054725\n-0.000000 -0.000000 9.164174\nHo O\n16 24\ndirect\n0.499991 0.499991 0.499991 Ho\n0.750001 0.782461 0.032462 Ho\n0.467539 0.250000 0.717539 Ho\n0.717539 0.467539 0.250001 Ho\n0.032462 0.750000 0.782461 Ho\n0.782461 0.032461 0.750000 Ho\n0.750000 0.282468 0.532468 Ho\n0.250001 0.717539 0.467539 Ho\n0.217533 0.967533 0.250001 Ho\n0.532468 0.750000 0.282468 Ho\n0.282468 0.532468 0.750000 Ho\n0.250000 0.217533 0.967532 Ho\n0.000010 0.500000 0.000000 Ho\n0.500000 0.000000 0.000010 Ho\n0.967533 0.250000 0.217533 Ho\n0.000000 0.000010 0.500000 Ho\n0.270917 0.739590 0.227746 O\n0.229084 0.456828 0.468673 O\n0.011845 0.043172 0.272255 O\n0.031327 0.488155 0.760410 O\n0.729095 0.260417 0.772267 O\n0.227745 0.270917 0.739590 O\n0.988152 0.956828 0.727735 O\n0.511850 0.239583 0.968677 O\n0.543173 0.531323 0.770906 O\n0.531323 0.770906 0.543173 O\n0.772267 0.729095 0.260418 O\n0.956829 0.727734 0.988152 O\n0.968678 0.511849 0.239584 O\n0.488156 0.760410 0.031328 O\n0.260418 0.772267 0.729095 O\n0.239584 0.968678 0.511850 O\n0.770906 0.543172 0.531324 O\n0.043172 0.272255 0.011845 O\n0.760410 0.031327 0.488155 O\n0.739590 0.227745 0.270917 O\n0.468673 0.229083 0.456828 O\n0.456829 0.468673 0.229084 O\n0.727735 0.988151 0.956829 O\n0.272255 0.011845 0.043172 O\n",
"nsites": 40,
"nelements": 2,
"elements": [
"Ho",
"O"
],
"chemical_system": "Ho-O",
"density": 8.472480397457781,
"density_atomic": 0.06751525193570142,
"volume": 592.4587238168682,
"volume_molar": 8.919674573287862,
"formula_full": "Ho16 O24",
"formula_reduced": "Ho2O3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.5464506999999998,
"spacegroup": 206
},
{
"id": "jvasp-118002",
"created_at": "2022-09-04T14:38:30.423404Z",
"updated_at": "2022-09-04T14:38:30.423436Z",
"structure_string": "Cd2 In1\n1.0\n5.246792 0.000000 -1.340586\n0.000000 3.099044 0.000000\n-1.456028 0.000000 5.215923\nCd In\n2 1\ndirect\n-0.199994 0.000000 -0.200042 Cd\n0.133338 0.000000 0.466704 Cd\n0.466656 0.000000 0.133337 In\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Cd",
"In"
],
"chemical_system": "Cd-In",
"density": 7.160629936768916,
"density_atomic": 0.03808943713142839,
"volume": 78.76199350619012,
"volume_molar": 15.810527047749428,
"formula_full": "Cd2 In1",
"formula_reduced": "Cd2In",
"formula_anonymous": "AB2",
"energy_above_hull": 0.1669645833333333,
"spacegroup": 191
},
{
"id": "jvasp-14495",
"created_at": "2022-09-04T14:38:11.286534Z",
"updated_at": "2022-09-04T14:38:11.286555Z",
"structure_string": "La1 Ni5\n1.0\n2.504204 -4.337408 0.000000\n2.504204 4.337408 0.000000\n0.000000 0.000000 3.973355\nLa Ni\n1 5\ndirect\n0.000000 0.000000 0.000000 La\n-0.000001 0.500000 0.499999 Ni\n0.333332 0.666666 0.000000 Ni\n0.666666 0.333332 0.000000 Ni\n0.499999 0.499999 0.499999 Ni\n0.500000 -0.000001 0.499999 Ni\n",
"nsites": 6,
"nelements": 2,
"elements": [
"La",
"Ni"
],
"chemical_system": "La-Ni",
"density": 8.318016655227558,
"density_atomic": 0.06951265952586977,
"volume": 86.31521281051037,
"volume_molar": 8.663372687904143,
"formula_full": "La1 Ni5",
"formula_reduced": "LaNi5",
"formula_anonymous": "AB5",
"energy_above_hull": 1.2534078333333332,
"spacegroup": 191
},
{
"id": "jvasp-17498",
"created_at": "2022-09-04T14:38:18.795937Z",
"updated_at": "2022-09-04T14:38:18.795958Z",
"structure_string": "U1 Pb3\n1.0\n4.824896 -0.000000 0.000000\n-0.000000 4.824896 0.000000\n-0.000000 -0.000000 4.824896\nU Pb\n1 3\ndirect\n0.000000 0.000000 0.000000 U\n0.000000 0.500000 0.500000 Pb\n0.500000 0.500000 0.000000 Pb\n0.500000 0.000000 0.500000 Pb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"U",
"Pb"
],
"chemical_system": "Pb-U",
"density": 12.708556976163605,
"density_atomic": 0.03561198005468908,
"volume": 112.32175222656046,
"volume_molar": 16.910435057954764,
"formula_full": "U1 Pb3",
"formula_reduced": "UPb3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.7106071150000002,
"spacegroup": 221
},
{
"id": "jvasp-7629",
"created_at": "2022-09-04T14:38:11.293267Z",
"updated_at": "2022-09-04T14:38:11.293293Z",
"structure_string": "Sn1 S1\n1.0\n3.978992 -0.000000 2.297272\n1.326331 3.751430 2.297272\n0.000000 0.000000 4.594544\nSn S\n1 1\ndirect\n0.000000 0.000000 0.000000 Sn\n0.250000 0.250000 0.250000 S\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Sn",
"S"
],
"chemical_system": "S-Sn",
"density": 3.650615610596642,
"density_atomic": 0.029162024308093133,
"volume": 68.58234458864209,
"volume_molar": 20.650626638181347,
"formula_full": "Sn1 S1",
"formula_reduced": "SnS",
"formula_anonymous": "AB",
"energy_above_hull": 0.6627358500000001,
"spacegroup": 216
}
]
}