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=spacegroup&page=4385",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=spacegroup&page=4383",
"results": [
{
"id": "jvasp-41330",
"created_at": "2022-09-04T14:37:52.367113Z",
"updated_at": "2022-09-04T14:37:52.367135Z",
"structure_string": "Hf2 Os1 Rh1\n1.0\n0.000000 3.258408 3.258408\n3.258408 -0.000000 3.258408\n3.258408 3.258408 0.000000\nHf Os Rh\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Hf\n0.500001 0.500001 0.500001 Hf\n0.250001 0.250001 0.250001 Os\n0.750000 0.750000 0.750000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Os",
"Rh"
],
"chemical_system": "Hf-Os-Rh",
"density": 15.602465549225812,
"density_atomic": 0.05781141583177709,
"volume": 69.19048673084612,
"volume_molar": 10.416871258651687,
"formula_full": "Hf2 Os1 Rh1",
"formula_reduced": "Hf2OsRh",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.742451,
"spacegroup": 225
},
{
"id": "jvasp-25323",
"created_at": "2022-09-04T14:37:52.373652Z",
"updated_at": "2022-09-04T14:37:52.373681Z",
"structure_string": "Tb1\n1.0\n3.047049 0.000000 1.759215\n1.015683 2.872785 1.759215\n0.000000 -0.000000 3.518429\nTb\n1\ndirect\n0.000000 0.000000 0.000000 Tb\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Tb"
],
"chemical_system": "Tb",
"density": 8.568620719048694,
"density_atomic": 0.03246898000035613,
"volume": 30.798626873681634,
"volume_molar": 18.547366624802955,
"formula_full": "Tb1",
"formula_reduced": "Tb",
"formula_anonymous": "A",
"energy_above_hull": 0.01113,
"spacegroup": 225
},
{
"id": "jvasp-39969",
"created_at": "2022-09-04T14:37:51.475797Z",
"updated_at": "2022-09-04T14:37:51.475807Z",
"structure_string": "Mg1 Sc1 Rh2\n1.0\n0.000000 3.161802 3.161802\n3.161802 0.000000 3.161802\n3.161802 3.161802 0.000000\nMg Sc Rh\n1 1 2\ndirect\n0.249999 0.249999 0.249999 Mg\n0.750000 0.750000 0.750000 Sc\n0.000000 0.000000 0.000000 Rh\n0.500001 0.500001 0.500001 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Sc",
"Rh"
],
"chemical_system": "Mg-Rh-Sc",
"density": 7.225390745650818,
"density_atomic": 0.06327410140130559,
"volume": 63.21701788589075,
"volume_molar": 9.517544503406793,
"formula_full": "Mg1 Sc1 Rh2",
"formula_reduced": "MgScRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.669352575,
"spacegroup": 225
},
{
"id": "jvasp-40011",
"created_at": "2022-09-04T14:37:51.535790Z",
"updated_at": "2022-09-04T14:37:51.535803Z",
"structure_string": "Lu1 Tc2 W1\n1.0\n0.000000 3.211059 3.211059\n3.211059 0.000000 3.211059\n3.211059 3.211059 -0.000000\nLu Tc W\n1 2 1\ndirect\n0.250000 0.250000 0.250000 Lu\n0.000000 0.000000 0.000000 Tc\n0.499999 0.499999 0.499999 Tc\n0.750000 0.750000 0.750000 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Lu",
"Tc",
"W"
],
"chemical_system": "Lu-Tc-W",
"density": 13.912852395515246,
"density_atomic": 0.06040670397298547,
"volume": 66.21781585349936,
"volume_molar": 9.969325197238318,
"formula_full": "Lu1 Tc2 W1",
"formula_reduced": "LuTc2W",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.0014496875,
"spacegroup": 225
},
{
"id": "jvasp-38439",
"created_at": "2022-09-04T14:37:51.542771Z",
"updated_at": "2022-09-04T14:37:51.542806Z",
"structure_string": "Pr1 Nd1 Hg2\n1.0\n0.000000 3.829235 3.829235\n3.829235 0.000000 3.829235\n3.829235 3.829235 0.000000\nPr Nd Hg\n1 1 2\ndirect\n0.749998 0.749998 0.749998 Pr\n0.250000 0.250000 0.250000 Nd\n0.000000 0.000000 0.000000 Hg\n0.499998 0.499998 0.499998 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pr",
"Nd",
"Hg"
],
"chemical_system": "Hg-Nd-Pr",
"density": 10.148825927748529,
"density_atomic": 0.035620001733429524,
"volume": 112.29645719657512,
"volume_molar": 16.90662680217726,
"formula_full": "Pr1 Nd1 Hg2",
"formula_reduced": "PrNdHg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-10104",
"created_at": "2022-09-04T14:37:51.550349Z",
"updated_at": "2022-09-04T14:37:51.550376Z",
"structure_string": "Ba2 Y1 Nb1 O6\n1.0\n5.223782 0.000000 3.015952\n1.741260 4.925029 3.015952\n0.000000 0.000000 6.031903\nBa Y Nb O\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 Ba\n0.250000 0.250000 0.250000 Ba\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.499999 Nb\n0.262596 0.737404 0.737403 O\n0.262596 0.737404 0.262595 O\n0.737404 0.262596 0.737403 O\n0.262596 0.262596 0.737404 O\n0.737404 0.262596 0.262596 O\n0.737404 0.737404 0.262595 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"Y",
"Nb",
"O"
],
"chemical_system": "Ba-Nb-O-Y",
"density": 5.911583365195546,
"density_atomic": 0.06443944842384144,
"volume": 155.18444438298727,
"volume_molar": 9.345425678367407,
"formula_full": "Ba2 Y1 Nb1 O6",
"formula_reduced": "Ba2YNbO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.3486227789999994,
"spacegroup": 225
},
{
"id": "jvasp-40012",
"created_at": "2022-09-04T14:37:51.564596Z",
"updated_at": "2022-09-04T14:37:51.564613Z",
"structure_string": "Lu1 Ta1 Ru2\n1.0\n-0.000000 3.230521 3.230521\n3.230521 0.000000 3.230521\n3.230521 3.230521 0.000000\nLu Ta Ru\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Lu\n0.750000 0.750000 0.750000 Ta\n0.000000 0.000000 0.000000 Ru\n0.500000 0.500000 0.500000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Lu",
"Ta",
"Ru"
],
"chemical_system": "Lu-Ru-Ta",
"density": 13.742897472446202,
"density_atomic": 0.05932152268459325,
"volume": 67.42915250620942,
"volume_molar": 10.151696192997496,
"formula_full": "Lu1 Ta1 Ru2",
"formula_reduced": "LuTaRu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.1226189875,
"spacegroup": 225
},
{
"id": "jvasp-25344",
"created_at": "2022-09-04T14:37:51.581720Z",
"updated_at": "2022-09-04T14:37:51.581752Z",
"structure_string": "Mn1\n1.0\n2.142782 -0.000000 1.237136\n0.714261 2.020235 1.237136\n0.000000 -0.000000 2.474272\nMn\n1\ndirect\n0.000000 0.000000 0.000000 Mn\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Mn"
],
"chemical_system": "Mn",
"density": 8.517163364313621,
"density_atomic": 0.09336254443261868,
"volume": 10.710933448495684,
"volume_molar": 6.450274889783321,
"formula_full": "Mn1",
"formula_reduced": "Mn",
"formula_anonymous": "A",
"energy_above_hull": 0.0755800000000004,
"spacegroup": 225
},
{
"id": "jvasp-39911",
"created_at": "2022-09-04T14:37:51.635423Z",
"updated_at": "2022-09-04T14:37:51.635444Z",
"structure_string": "Yb1 Sn1 Au2\n1.0\n0.000000 3.498141 3.498141\n3.498141 0.000000 3.498141\n3.498141 3.498141 0.000000\nYb Sn Au\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Yb\n0.250001 0.250001 0.250001 Sn\n0.500001 0.500001 0.500001 Au\n0.000000 0.000000 0.000000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Yb",
"Sn",
"Au"
],
"chemical_system": "Au-Sn-Yb",
"density": 13.299356857389135,
"density_atomic": 0.046721638378889936,
"volume": 85.61343606065203,
"volume_molar": 12.889404072612663,
"formula_full": "Yb1 Sn1 Au2",
"formula_reduced": "YbSnAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-38792",
"created_at": "2022-09-04T14:37:51.665727Z",
"updated_at": "2022-09-04T14:37:51.665761Z",
"structure_string": "Tb1 Al1 Ag2\n1.0\n0.000000 3.418968 3.418968\n3.418968 -0.000000 3.418968\n3.418968 3.418968 -0.000000\nTb Al Ag\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Tb\n0.250000 0.250000 0.250000 Al\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Tb",
"Al",
"Ag"
],
"chemical_system": "Ag-Al-Tb",
"density": 8.3440040865754,
"density_atomic": 0.05004317866621231,
"volume": 79.93097374329427,
"volume_molar": 12.033889374149556,
"formula_full": "Tb1 Al1 Ag2",
"formula_reduced": "TbAlAg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.55322143,
"spacegroup": 225
},
{
"id": "jvasp-39267",
"created_at": "2022-09-04T14:37:51.706777Z",
"updated_at": "2022-09-04T14:37:51.706804Z",
"structure_string": "Lu2 Al1 Zn1\n1.0\n-0.000000 3.501763 3.501763\n3.501763 0.000000 3.501763\n3.501763 3.501763 -0.000000\nLu Al Zn\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Lu\n0.500001 0.500001 0.500001 Lu\n0.249999 0.249999 0.249999 Al\n0.749999 0.749999 0.749999 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Lu",
"Al",
"Zn"
],
"chemical_system": "Al-Lu-Zn",
"density": 8.552633977103792,
"density_atomic": 0.0465768106464955,
"volume": 85.8796457825084,
"volume_molar": 12.92948288303015,
"formula_full": "Lu2 Al1 Zn1",
"formula_reduced": "Lu2AlZn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5973786750000001,
"spacegroup": 225
},
{
"id": "jvasp-40427",
"created_at": "2022-09-04T14:37:51.706989Z",
"updated_at": "2022-09-04T14:37:51.707012Z",
"structure_string": "Ba2 Cd1 Pb1\n1.0\n0.000000 4.248546 4.248546\n4.248546 0.000000 4.248546\n4.248546 4.248546 0.000000\nBa Cd Pb\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.500000 Ba\n0.250000 0.250000 0.250000 Cd\n0.750001 0.750001 0.750001 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Cd",
"Pb"
],
"chemical_system": "Ba-Cd-Pb",
"density": 6.433958865982437,
"density_atomic": 0.026080086122107868,
"volume": 153.37372665381017,
"volume_molar": 23.090954269875212,
"formula_full": "Ba2 Cd1 Pb1",
"formula_reduced": "Ba2CdPb",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}