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&page=3665",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density&page=3663",
"results": [
{
"id": "jvasp-58366",
"created_at": "2022-09-04T14:37:12.596500Z",
"updated_at": "2022-09-04T14:37:12.596514Z",
"structure_string": "U2 Ge2 O8\n1.0\n4.750754 0.000013 -1.959877\n-0.808503 4.681525 -1.959816\n-0.033610 -0.039763 6.656354\nU Ge O\n2 2 8\ndirect\n0.375000 0.125005 0.749999 U\n0.625000 0.874997 0.249999 U\n0.875005 0.624994 0.749998 Ge\n0.124995 0.375007 0.250001 Ge\n0.301268 0.452652 0.087248 O\n0.634602 0.801273 0.587255 O\n0.952650 0.285987 0.587253 O\n0.785982 0.134599 0.087253 O\n0.214018 0.865402 0.912746 O\n0.047350 0.714014 0.412745 O\n0.365398 0.198728 0.412744 O\n0.698732 0.547349 0.912750 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"U",
"Ge",
"O"
],
"chemical_system": "Ge-O-U",
"density": 8.447310930960555,
"density_atomic": 0.08146588093071516,
"volume": 147.3009297009348,
"volume_molar": 7.392224439482451,
"formula_full": "U2 Ge2 O8",
"formula_reduced": "UGeO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.599357658333333,
"spacegroup": 88
},
{
"id": "jvasp-70975",
"created_at": "2022-09-04T14:36:17.251083Z",
"updated_at": "2022-09-04T14:36:17.251104Z",
"structure_string": "Ta1 Be2 Zn1\n1.0\n2.768122 -3.648650 0.000000\n2.768122 3.648650 0.000000\n0.000000 0.000000 2.572718\nTa Be Zn\n1 2 1\ndirect\n0.500000 -0.000000 0.500000 Ta\n0.000000 0.000000 0.000000 Be\n0.500000 0.500000 0.000000 Be\n-0.000000 0.500000 0.500000 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ta",
"Be",
"Zn"
],
"chemical_system": "Be-Ta-Zn",
"density": 8.447731973164826,
"density_atomic": 0.07696980359579805,
"volume": 51.968431945152695,
"volume_molar": 7.824030306254754,
"formula_full": "Ta1 Be2 Zn1",
"formula_reduced": "TaBe2Zn",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.25215295,
"spacegroup": 65
},
{
"id": "jvasp-111615",
"created_at": "2022-09-04T14:38:37.165160Z",
"updated_at": "2022-09-04T14:38:37.165183Z",
"structure_string": "Yb1 Ga6 Fe6\n1.0\n6.442999 -0.006893 -1.073213\n-1.606038 4.325320 -4.623453\n-0.014276 0.006893 6.531755\nYb Ga Fe\n1 6 6\ndirect\n0.000000 0.000000 0.000000 Yb\n0.322958 -0.000000 0.322959 Ga\n0.677041 -0.000000 0.677042 Ga\n0.659379 0.659380 0.000001 Ga\n0.340621 0.340621 0.000000 Ga\n0.177231 0.677231 0.500000 Ga\n0.822768 0.322769 0.500001 Ga\n0.753944 0.500000 0.253945 Fe\n0.246055 0.500000 0.746057 Fe\n-0.000000 -0.000000 0.500000 Fe\n-0.000000 0.500000 0.000000 Fe\n0.500000 0.000000 0.000000 Fe\n0.500000 0.500000 0.500001 Fe\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Yb",
"Ga",
"Fe"
],
"chemical_system": "Fe-Ga-Yb",
"density": 8.44787458749173,
"density_atomic": 0.07138725204023126,
"volume": 182.10534273925649,
"volume_molar": 8.435876977875742,
"formula_full": "Yb1 Ga6 Fe6",
"formula_reduced": "Yb(GaFe)6",
"formula_anonymous": "AB6C6",
"energy_above_hull": 1.601294434615384,
"spacegroup": 71
},
{
"id": "jvasp-98377",
"created_at": "2022-09-04T14:36:14.832808Z",
"updated_at": "2022-09-04T14:36:14.832826Z",
"structure_string": "Mg4 Ge2 B4 Rh10\n1.0\n2.929302 0.000000 0.000000\n-0.000000 9.392835 0.000000\n0.000000 0.000000 9.392835\nMg Ge B Rh\n4 2 4 10\ndirect\n0.000000 0.674429 0.174429 Mg\n0.000000 0.825570 0.674429 Mg\n0.000000 0.174429 0.325571 Mg\n0.000000 0.325571 0.825570 Mg\n0.000000 0.500000 0.500000 Ge\n0.000000 0.000000 0.000000 Ge\n0.000000 0.874856 0.374856 B\n0.000000 0.625143 0.874856 B\n0.000000 0.374856 0.125144 B\n0.000000 0.125144 0.625143 B\n0.500000 0.213034 0.072888 Rh\n0.500000 0.427112 0.286966 Rh\n0.500000 0.572887 0.713034 Rh\n0.500000 0.286966 0.572887 Rh\n0.500000 0.713034 0.427112 Rh\n0.500000 0.786966 0.927112 Rh\n0.500000 0.072888 0.786966 Rh\n0.500000 0.927112 0.213034 Rh\n0.500000 0.000000 0.500000 Rh\n0.500000 0.500000 0.000000 Rh\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Mg",
"Ge",
"B",
"Rh"
],
"chemical_system": "B-Ge-Mg-Rh",
"density": 8.44794208289213,
"density_atomic": 0.07738779292208954,
"volume": 258.43869226423186,
"volume_molar": 7.781770913227637,
"formula_full": "Mg4 Ge2 B4 Rh10",
"formula_reduced": "Mg2GeB2Rh5",
"formula_anonymous": "AB2C2D5",
"energy_above_hull": 2.6354094216666666,
"spacegroup": 127
},
{
"id": "jvasp-36024",
"created_at": "2022-09-04T14:36:51.287411Z",
"updated_at": "2022-09-04T14:36:51.287438Z",
"structure_string": "Tc1 B1\n1.0\n2.203142 2.203142 -0.000000\n2.203142 0.000000 -2.203142\n0.000000 2.203142 -2.203142\nTc B\n1 1\ndirect\n0.000000 0.000000 0.000000 Tc\n0.500000 0.500000 0.500000 B\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Tc",
"B"
],
"chemical_system": "B-Tc",
"density": 8.44820481067606,
"density_atomic": 0.09351311642532857,
"volume": 21.387374054601484,
"volume_molar": 6.439888852179104,
"formula_full": "Tc1 B1",
"formula_reduced": "TcB",
"formula_anonymous": "AB",
"energy_above_hull": 3.311772041666666,
"spacegroup": 225
},
{
"id": "jvasp-16762",
"created_at": "2022-09-04T14:38:32.918638Z",
"updated_at": "2022-09-04T14:38:32.918654Z",
"structure_string": "Al6 W3\n1.0\n2.438891 -4.224284 -0.000000\n2.438891 4.224284 -0.000000\n-0.000000 0.000000 6.805218\nAl W\n6 3\ndirect\n0.168970 0.831029 0.666667 Al\n0.831030 0.662061 0.000000 Al\n0.337939 0.168970 0.333333 Al\n0.831029 0.168970 0.666667 Al\n0.168970 0.337939 0.000000 Al\n0.662061 0.831030 0.333333 Al\n0.000000 0.500000 0.333333 W\n0.500000 0.000000 0.000000 W\n0.500000 0.500000 0.666667 W\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Al",
"W"
],
"chemical_system": "Al-W",
"density": 8.44831863527124,
"density_atomic": 0.06418373297380926,
"volume": 140.22244551703668,
"volume_molar": 9.382658940166953,
"formula_full": "Al6 W3",
"formula_reduced": "Al2W",
"formula_anonymous": "AB2",
"energy_above_hull": 3.382735200000001,
"spacegroup": 181
},
{
"id": "jvasp-71493",
"created_at": "2022-09-04T14:36:20.873901Z",
"updated_at": "2022-09-04T14:36:20.873923Z",
"structure_string": "Be2 Pd1 Ru1\n1.0\n2.800775 0.000000 -0.000000\n0.000000 2.800775 -0.000000\n-0.000000 -0.000000 5.650390\nBe Pd Ru\n2 1 1\ndirect\n0.000000 0.000000 0.737760 Be\n0.000000 0.000000 0.262240 Be\n0.499999 0.499999 0.000000 Pd\n0.499999 0.499999 0.500000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Pd",
"Ru"
],
"chemical_system": "Be-Pd-Ru",
"density": 8.448671798545167,
"density_atomic": 0.09024541039605632,
"volume": 44.32358368636548,
"volume_molar": 6.673071498673316,
"formula_full": "Be2 Pd1 Ru1",
"formula_reduced": "Be2PdRu",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.3611421,
"spacegroup": 123
},
{
"id": "jvasp-14225",
"created_at": "2022-09-04T14:36:41.338310Z",
"updated_at": "2022-09-04T14:36:41.338339Z",
"structure_string": "Ag8 S1\n1.0\n5.320948 0.000000 2.906690\n2.188959 5.301410 2.316494\n0.093821 -0.639442 6.151825\nAg S\n8 1\ndirect\n0.611088 0.591498 0.186328 Ag\n0.111135 0.212544 0.565186 Ag\n0.111135 0.565187 0.212543 Ag\n0.077093 0.652150 0.652149 Ag\n0.618609 0.652150 0.652149 Ag\n0.145155 0.125615 0.125615 Ag\n0.603615 0.125615 0.125615 Ag\n0.611087 0.186329 0.591497 Ag\n0.111085 0.888915 0.888913 S\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Ag",
"S"
],
"chemical_system": "Ag-S",
"density": 8.449053010766564,
"density_atomic": 0.05116503411625448,
"volume": 175.9013778736212,
"volume_molar": 11.770031749254402,
"formula_full": "Ag8 S1",
"formula_reduced": "Ag8S",
"formula_anonymous": "AB8",
"energy_above_hull": 1.111111111107982e-06,
"spacegroup": 71
},
{
"id": "jvasp-18509",
"created_at": "2022-09-04T14:36:54.801253Z",
"updated_at": "2022-09-04T14:36:54.801270Z",
"structure_string": "Ag8 S1\n1.0\n5.319569 0.000000 2.905936\n2.188003 5.302006 2.316605\n0.092780 -0.639089 6.152092\nAg S\n8 1\ndirect\n0.611122 0.591523 0.186234 Ag\n0.111114 0.212571 0.565202 Ag\n0.111113 0.565202 0.212571 Ag\n0.077234 0.652086 0.652086 Ag\n0.618595 0.652086 0.652086 Ag\n0.145044 0.125687 0.125687 Ag\n0.603584 0.125687 0.125687 Ag\n0.611123 0.186233 0.591522 Ag\n0.111070 0.888929 0.888930 S\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Ag",
"S"
],
"chemical_system": "Ag-S",
"density": 8.449179173932707,
"density_atomic": 0.051165798124089654,
"volume": 175.8987513137738,
"volume_molar": 11.769855999108675,
"formula_full": "Ag8 S1",
"formula_reduced": "Ag8S",
"formula_anonymous": "AB8",
"energy_above_hull": 0.0,
"spacegroup": 71
},
{
"id": "jvasp-11995",
"created_at": "2022-09-04T14:36:59.098282Z",
"updated_at": "2022-09-04T14:36:59.098305Z",
"structure_string": "Nb3 Ni1\n1.0\n4.047575 -0.000000 0.000000\n0.000000 4.047575 0.000000\n-0.000000 -0.000000 4.047575\nNb Ni\n3 1\ndirect\n0.000000 0.499999 0.499999 Nb\n0.499999 0.499999 0.000000 Nb\n0.499999 0.000000 0.499999 Nb\n0.000000 0.000000 0.000000 Ni\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Nb",
"Ni"
],
"chemical_system": "Nb-Ni",
"density": 8.449394783019493,
"density_atomic": 0.060321936745726494,
"volume": 66.31086824783324,
"volume_molar": 9.983334562656658,
"formula_full": "Nb3 Ni1",
"formula_reduced": "Nb3Ni",
"formula_anonymous": "AB3",
"energy_above_hull": 4.39606765,
"spacegroup": 221
},
{
"id": "jvasp-56989",
"created_at": "2022-09-04T14:37:05.244671Z",
"updated_at": "2022-09-04T14:37:05.244697Z",
"structure_string": "Yb2 In4\n1.0\n2.442200 -4.230014 -0.000000\n2.442200 4.230014 0.000000\n-0.000000 0.000000 7.660311\nYb In\n2 4\ndirect\n0.000000 0.000000 0.750000 Yb\n0.000000 0.000000 0.250000 Yb\n0.333333 0.666667 0.950829 In\n0.333333 0.666667 0.549170 In\n0.666667 0.333333 0.049170 In\n0.666667 0.333333 0.450830 In\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Yb",
"In"
],
"chemical_system": "In-Yb",
"density": 8.449585596406765,
"density_atomic": 0.0379098286285858,
"volume": 158.27030131905468,
"volume_molar": 15.88543387784935,
"formula_full": "Yb2 In4",
"formula_reduced": "YbIn2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-18869",
"created_at": "2022-09-04T14:36:32.131310Z",
"updated_at": "2022-09-04T14:36:32.131337Z",
"structure_string": "Nb1 Co1 Sb1\n1.0\n3.668923 0.000000 2.118254\n1.222974 3.459094 2.118254\n0.000000 0.000000 4.236507\nNb Co Sb\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Nb\n0.250000 0.250000 0.250000 Co\n0.499999 0.499999 0.500000 Sb\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Nb",
"Co",
"Sb"
],
"chemical_system": "Co-Nb-Sb",
"density": 8.449978934539134,
"density_atomic": 0.05579719476583427,
"volume": 53.766143846302455,
"volume_molar": 10.792909545494707,
"formula_full": "Nb1 Co1 Sb1",
"formula_reduced": "NbCoSb",
"formula_anonymous": "ABC",
"energy_above_hull": 3.0093088000000003,
"spacegroup": 216
}
]
}