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=-volume&page=1226",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume&page=1224",
"results": [
{
"id": "jvasp-56919",
"created_at": "2022-09-04T14:37:08.693861Z",
"updated_at": "2022-09-04T14:37:08.693889Z",
"structure_string": "Er4 Al6 Co2\n1.0\n2.734245 -4.735851 0.000000\n2.734245 4.735851 0.000000\n-0.000000 0.000000 8.494736\nEr Al Co\n4 6 2\ndirect\n0.333332 0.666666 0.555884 Er\n0.666666 0.333332 0.055884 Er\n0.666666 0.333332 0.444116 Er\n0.333332 0.666666 0.944116 Er\n0.324257 0.162129 0.750000 Al\n0.162129 0.324257 0.250000 Al\n0.162129 0.837870 0.250000 Al\n0.837870 0.162129 0.750000 Al\n0.675741 0.837869 0.250000 Al\n0.837869 0.675741 0.750000 Al\n0.000000 0.000000 0.000000 Co\n0.000000 0.000000 0.500000 Co\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Er",
"Al",
"Co"
],
"chemical_system": "Al-Co-Er",
"density": 7.161509950197623,
"density_atomic": 0.054546376684574197,
"volume": 219.99628076842762,
"volume_molar": 11.040404745532935,
"formula_full": "Er4 Al6 Co2",
"formula_reduced": "Er2Al3Co",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.9629715500000005,
"spacegroup": 194
},
{
"id": "jvasp-64081",
"created_at": "2022-09-04T14:36:12.859574Z",
"updated_at": "2022-09-04T14:36:12.859599Z",
"structure_string": "Ba4 Hf1 Nb1\n1.0\n0.000000 4.791374 4.791374\n4.791374 0.000000 4.791374\n4.791374 4.791374 0.000000\nBa Hf Nb\n4 1 1\ndirect\n0.124520 0.625159 0.625159 Ba\n0.625159 0.625159 0.625159 Ba\n0.625159 0.124520 0.625159 Ba\n0.625159 0.625159 0.124520 Ba\n0.250000 0.250000 0.250000 Hf\n0.000000 0.000000 0.000000 Nb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Hf",
"Nb"
],
"chemical_system": "Ba-Hf-Nb",
"density": 6.1947764313689335,
"density_atomic": 0.0272735103419282,
"volume": 219.99368342314415,
"volume_molar": 22.080548798084212,
"formula_full": "Ba4 Hf1 Nb1",
"formula_reduced": "Ba4HfNb",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.077187713333333,
"spacegroup": 216
},
{
"id": "jvasp-110520",
"created_at": "2022-09-04T14:38:38.643208Z",
"updated_at": "2022-09-04T14:38:38.643232Z",
"structure_string": "Zr3 Co1 Se6\n1.0\n5.758587 -0.007854 4.192537\n2.129306 5.350461 4.192537\n-0.011596 -0.007854 7.123099\nZr Co Se\n3 1 6\ndirect\n0.500000 0.500001 0.500000 Zr\n0.167688 0.167688 0.167688 Zr\n0.832313 0.832314 0.832313 Zr\n0.000000 0.000000 0.000000 Co\n0.922253 0.592646 0.256096 Se\n0.256096 0.922253 0.592646 Se\n0.592645 0.256097 0.922252 Se\n0.407355 0.743904 0.077748 Se\n0.743904 0.077749 0.407354 Se\n0.077747 0.407355 0.743904 Se\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Zr",
"Co",
"Se"
],
"chemical_system": "Co-Se-Zr",
"density": 6.087208525424191,
"density_atomic": 0.04546082446954415,
"volume": 219.9696137649101,
"volume_molar": 13.24687977015122,
"formula_full": "Zr3 Co1 Se6",
"formula_reduced": "Zr3CoSe6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 2.8243004600000003,
"spacegroup": 148
},
{
"id": "jvasp-30988",
"created_at": "2022-09-04T14:38:33.268985Z",
"updated_at": "2022-09-04T14:38:33.269000Z",
"structure_string": "Er4 Pd4 Pb2\n1.0\n7.836469 -0.000000 0.000000\n-0.000000 7.836469 0.000000\n-0.000000 0.000000 3.581748\nEr Pd Pb\n4 4 2\ndirect\n0.670145 0.170145 0.500000 Er\n0.170145 0.329855 0.500000 Er\n0.829855 0.670145 0.500000 Er\n0.329855 0.829855 0.500000 Er\n0.373983 0.126017 0.000000 Pd\n0.126017 0.626017 0.000000 Pd\n0.626017 0.873983 0.000000 Pd\n0.873983 0.373983 0.000000 Pd\n0.000000 0.000000 0.000000 Pb\n0.500000 0.500000 0.000000 Pb\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Er",
"Pd",
"Pb"
],
"chemical_system": "Er-Pb-Pd",
"density": 11.392941153574784,
"density_atomic": 0.04546363256431861,
"volume": 219.95602717958656,
"volume_molar": 13.246061566858558,
"formula_full": "Er4 Pd4 Pb2",
"formula_reduced": "Er2Pd2Pb",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.168218444,
"spacegroup": 127
},
{
"id": "jvasp-66647",
"created_at": "2022-09-04T14:35:58.859544Z",
"updated_at": "2022-09-04T14:35:58.859570Z",
"structure_string": "Ba4 Nb1 Ru1\n1.0\n-0.000000 4.791092 4.791092\n4.791092 -0.000000 4.791092\n4.791092 4.791092 0.000000\nBa Nb Ru\n4 1 1\ndirect\n0.123474 0.625508 0.625508 Ba\n0.625508 0.625508 0.625508 Ba\n0.625508 0.123474 0.625508 Ba\n0.625508 0.625508 0.123474 Ba\n0.250000 0.250000 0.250000 Nb\n0.000000 0.000000 0.000000 Ru\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Nb",
"Ru"
],
"chemical_system": "Ba-Nb-Ru",
"density": 5.611391589583344,
"density_atomic": 0.027278326519087386,
"volume": 219.95484201721968,
"volume_molar": 22.076650324520987,
"formula_full": "Ba4 Nb1 Ru1",
"formula_reduced": "Ba4NbRu",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.9120672966666663,
"spacegroup": 216
},
{
"id": "jvasp-50706",
"created_at": "2022-09-04T14:36:18.692110Z",
"updated_at": "2022-09-04T14:36:18.692125Z",
"structure_string": "Li1 Sb3 P2 O10\n1.0\n-5.316160 0.463483 -0.178509\n0.049107 -6.817914 -0.266280\n2.377901 2.541345 6.260107\nLi Sb P O\n1 3 2 10\ndirect\n0.920151 0.395621 0.892078 Li\n0.553950 0.470358 0.332097 Sb\n-0.076725 -0.001211 0.047798 Sb\n0.366378 0.133820 0.780958 Sb\n0.621613 0.988430 0.387947 P\n0.316716 0.577295 0.721206 P\n0.734765 0.062988 0.640269 O\n0.480220 0.825303 0.864170 O\n0.452065 0.747608 0.258667 O\n0.263439 0.518868 0.475228 O\n0.048590 0.534884 0.744078 O\n0.238146 0.294277 0.035067 O\n0.732358 0.240529 0.046155 O\n0.517829 0.446168 0.804709 O\n0.879347 0.020035 0.330564 O\n0.435455 0.134606 0.326911 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Li",
"Sb",
"P",
"O"
],
"chemical_system": "Li-O-P-Sb",
"density": 4.485730874099147,
"density_atomic": 0.07274427895661292,
"volume": 219.94856818283847,
"volume_molar": 8.278507734734443,
"formula_full": "Li1 Sb3 P2 O10",
"formula_reduced": "LiSb3(PO5)2",
"formula_anonymous": "AB2C3D10",
"energy_above_hull": 2.65350151875,
"spacegroup": 1
},
{
"id": "jvasp-37364",
"created_at": "2022-09-04T14:37:58.997701Z",
"updated_at": "2022-09-04T14:37:58.997723Z",
"structure_string": "Sm2 Ni4 Bi4\n1.0\n4.647785 0.000000 -0.000000\n0.000000 4.647785 0.000000\n-0.000000 0.000000 10.181692\nSm Ni Bi\n2 4 4\ndirect\n0.000000 0.499999 0.774138 Sm\n0.499999 0.000000 0.225862 Sm\n0.000000 0.499999 0.373581 Ni\n0.499999 0.000000 0.626419 Ni\n0.499999 0.499999 0.000000 Ni\n0.000000 0.000000 0.000000 Ni\n0.000000 0.499999 0.125235 Bi\n0.499999 0.000000 0.874765 Bi\n0.499999 0.499999 0.500000 Bi\n0.000000 0.000000 0.500000 Bi\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Sm",
"Ni",
"Bi"
],
"chemical_system": "Bi-Ni-Sm",
"density": 10.353949460465483,
"density_atomic": 0.045466129509427224,
"volume": 219.9439474593178,
"volume_molar": 13.245334109100561,
"formula_full": "Sm2 Ni4 Bi4",
"formula_reduced": "Sm(NiBi)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.090154455,
"spacegroup": 129
},
{
"id": "jvasp-3297",
"created_at": "2022-09-04T14:36:10.903487Z",
"updated_at": "2022-09-04T14:36:10.903512Z",
"structure_string": "K3 Ag3 As2\n1.0\n5.531833 -0.005400 5.620430\n2.298446 5.031734 5.620430\n-0.008413 -0.005400 7.886085\nK Ag As\n3 3 2\ndirect\n0.089941 0.089941 0.089941 K\n0.910060 0.910058 0.910058 K\n0.500001 0.500000 0.500000 K\n0.500000 0.000000 0.500000 Ag\n0.500000 0.500000 0.000000 Ag\n0.000001 0.500000 0.499999 Ag\n0.756634 0.756632 0.756632 As\n0.243367 0.243367 0.243367 As\n",
"nsites": 8,
"nelements": 3,
"elements": [
"K",
"Ag",
"As"
],
"chemical_system": "Ag-As-K",
"density": 4.460063793163924,
"density_atomic": 0.03637337469635375,
"volume": 219.94109886102925,
"volume_molar": 16.556453203127422,
"formula_full": "K3 Ag3 As2",
"formula_reduced": "K3Ag3As2",
"formula_anonymous": "A2B3C3",
"energy_above_hull": 0.153582720625,
"spacegroup": 166
},
{
"id": "jvasp-97746",
"created_at": "2022-09-04T14:35:54.924143Z",
"updated_at": "2022-09-04T14:35:54.924174Z",
"structure_string": "H16 Pt2 O12\n1.0\n4.064714 3.653195 -0.267013\n-4.064714 3.653195 0.267013\n-0.013748 0.000000 7.406673\nH Pt O\n16 2 12\ndirect\n0.136777 0.618788 0.847283 H\n0.971213 0.949018 0.484743 H\n0.157278 0.157049 0.712284 H\n0.050980 0.028786 0.984743 H\n0.406071 0.762246 0.601717 H\n0.541582 0.473819 0.008399 H\n0.526179 0.458417 0.508399 H\n0.237753 0.593927 0.101717 H\n0.842949 0.842721 0.212284 H\n0.516608 0.139515 0.338645 H\n0.111012 0.254194 0.252693 H\n0.805940 0.377765 0.111171 H\n0.745804 0.888987 0.752693 H\n0.622233 0.194059 0.611171 H\n0.860484 0.483391 0.838644 H\n0.381211 0.863222 0.347283 H\n0.006339 0.496290 0.506127 Pt\n0.503709 -0.006339 0.006127 Pt\n0.143960 0.174601 0.575115 O\n0.188505 0.139485 0.927048 O\n0.354364 0.656819 0.496284 O\n0.674283 0.349005 0.005715 O\n0.650994 0.325716 0.505715 O\n0.590219 0.965869 0.747342 O\n0.398610 0.025034 0.266365 O\n0.034130 0.409780 0.247343 O\n0.974965 0.601389 0.766365 O\n0.825398 0.856039 0.075115 O\n0.343180 0.645635 0.996284 O\n0.860514 0.811494 0.427049 O\n",
"nsites": 30,
"nelements": 3,
"elements": [
"H",
"Pt",
"O"
],
"chemical_system": "H-O-Pt",
"density": 4.517063714478033,
"density_atomic": 0.13640120206960446,
"volume": 219.9394106856275,
"volume_molar": 4.4150202994009895,
"formula_full": "H16 Pt2 O12",
"formula_reduced": "H8PtO6",
"formula_anonymous": "AB6C8",
"energy_above_hull": 3.05977416,
"spacegroup": 9
},
{
"id": "jvasp-66169",
"created_at": "2022-09-04T14:35:49.107580Z",
"updated_at": "2022-09-04T14:35:49.107609Z",
"structure_string": "Ba4 In1 Re1\n1.0\n0.000000 4.790918 4.790918\n4.790918 -0.000000 4.790918\n4.790918 4.790918 -0.000000\nBa In Re\n4 1 1\ndirect\n0.122574 0.625809 0.625809 Ba\n0.625809 0.625809 0.625809 Ba\n0.625809 0.122574 0.625809 Ba\n0.625809 0.625809 0.122574 Ba\n0.250000 0.250000 0.250000 In\n0.000000 0.000000 0.000000 Re\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"In",
"Re"
],
"chemical_system": "Ba-In-Re",
"density": 6.420249747911742,
"density_atomic": 0.027281298768581506,
"volume": 219.93087832423495,
"volume_molar": 22.074245112316262,
"formula_full": "Ba4 In1 Re1",
"formula_reduced": "Ba4InRe",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.201021975,
"spacegroup": 216
},
{
"id": "jvasp-66295",
"created_at": "2022-09-04T14:35:50.123082Z",
"updated_at": "2022-09-04T14:35:50.123115Z",
"structure_string": "Ba4 Tc1 Pd1\n1.0\n0.000000 4.790872 4.790872\n4.790872 0.000000 4.790872\n4.790872 4.790872 0.000000\nBa Tc Pd\n4 1 1\ndirect\n0.125379 0.624873 0.624873 Ba\n0.624873 0.624873 0.624873 Ba\n0.624873 0.125379 0.624873 Ba\n0.624873 0.624873 0.125379 Ba\n0.000000 0.000000 0.000000 Tc\n0.250000 0.250000 0.250000 Pd\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Tc",
"Pd"
],
"chemical_system": "Ba-Pd-Tc",
"density": 5.691019157392388,
"density_atomic": 0.02728208460785636,
"volume": 219.9245433859623,
"volume_molar": 22.07360928081653,
"formula_full": "Ba4 Tc1 Pd1",
"formula_reduced": "Ba4TcPd",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.3214585133333332,
"spacegroup": 216
},
{
"id": "jvasp-21798",
"created_at": "2022-09-04T14:38:18.997916Z",
"updated_at": "2022-09-04T14:38:18.997931Z",
"structure_string": "Ba1 Al9 Ni2\n1.0\n3.990508 -6.911762 -0.000000\n3.990508 6.911762 0.000000\n0.000000 -0.000000 3.986589\nBa Al Ni\n1 9 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.000000 0.500000 0.000000 Al\n0.500000 0.500000 0.000000 Al\n0.500000 0.000000 0.000000 Al\n0.574133 0.787066 0.500000 Al\n0.787066 0.212934 0.500000 Al\n0.787066 0.574133 0.500000 Al\n0.212934 0.425868 0.500000 Al\n0.212934 0.787066 0.500000 Al\n0.425868 0.212934 0.500000 Al\n0.666667 0.333333 0.000000 Ni\n0.333333 0.666667 0.000000 Ni\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ba",
"Al",
"Ni"
],
"chemical_system": "Al-Ba-Ni",
"density": 3.756949468336715,
"density_atomic": 0.05456734522431076,
"volume": 219.91174301537723,
"volume_molar": 11.03616226012957,
"formula_full": "Ba1 Al9 Ni2",
"formula_reduced": "BaAl9Ni2",
"formula_anonymous": "AB2C9",
"energy_above_hull": 1.6968613308333336,
"spacegroup": 191
}
]
}