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=3504",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density&page=3502",
"results": [
{
"id": "jvasp-105516",
"created_at": "2022-09-04T14:38:45.613074Z",
"updated_at": "2022-09-04T14:38:45.613100Z",
"structure_string": "Er2 Mn2 Al2\n1.0\n4.627220 0.015635 -2.447817\n-1.637119 4.222951 -2.624831\n0.099222 -0.015635 5.233844\nEr Mn Al\n2 2 2\ndirect\n0.137315 0.887315 0.250000 Er\n0.862684 0.112684 0.749999 Er\n0.500000 -0.000001 -0.000001 Mn\n0.500000 0.500000 0.499999 Mn\n-0.000000 0.500000 0.500000 Al\n0.500000 0.499999 -0.000001 Al\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Er",
"Mn",
"Al"
],
"chemical_system": "Al-Er-Mn",
"density": 8.02075237131493,
"density_atomic": 0.058153593017519434,
"volume": 103.17505228253792,
"volume_molar": 10.355578129430041,
"formula_full": "Er2 Mn2 Al2",
"formula_reduced": "ErMnAl",
"formula_anonymous": "ABC",
"energy_above_hull": 2.0837100137931035,
"spacegroup": 74
},
{
"id": "jvasp-17738",
"created_at": "2022-09-04T14:38:29.673969Z",
"updated_at": "2022-09-04T14:38:29.673996Z",
"structure_string": "Pr2 Sb4 Pd2\n1.0\n4.517777 -0.000000 -0.000000\n0.000000 4.517777 0.000000\n-0.000000 -0.000000 9.957340\nPr Sb Pd\n2 4 2\ndirect\n0.500000 0.000000 0.753089 Pr\n0.000000 0.500000 0.246911 Pr\n0.500000 0.000000 0.152818 Sb\n0.000000 0.500000 0.847182 Sb\n0.500000 0.500000 0.500000 Sb\n0.000000 0.000000 0.500000 Sb\n0.500000 0.500000 0.000000 Pd\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Pr",
"Sb",
"Pd"
],
"chemical_system": "Pd-Pr-Sb",
"density": 8.02108082155304,
"density_atomic": 0.039363804855882846,
"volume": 203.23238643442303,
"volume_molar": 15.298675476235125,
"formula_full": "Pr2 Sb4 Pd2",
"formula_reduced": "PrSb2Pd",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4321244375000002,
"spacegroup": 129
},
{
"id": "jvasp-79615",
"created_at": "2022-09-04T14:37:16.432381Z",
"updated_at": "2022-09-04T14:37:16.432404Z",
"structure_string": "Sm3 Ga1\n1.0\n4.759438 0.000000 0.000000\n-0.000000 4.759438 0.000000\n0.000000 0.000000 4.759438\nSm Ga\n3 1\ndirect\n0.000000 0.500000 0.500000 Sm\n0.500000 0.500000 0.000000 Sm\n0.500000 0.000000 0.500000 Sm\n0.000000 0.000000 0.000000 Ga\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sm",
"Ga"
],
"chemical_system": "Ga-Sm",
"density": 8.021499365238043,
"density_atomic": 0.03710162829354507,
"volume": 107.81197979647483,
"volume_molar": 16.23147294871619,
"formula_full": "Sm3 Ga1",
"formula_reduced": "Sm3Ga",
"formula_anonymous": "AB3",
"energy_above_hull": 0.9991859166666666,
"spacegroup": 221
},
{
"id": "jvasp-9388",
"created_at": "2022-09-04T14:38:08.962600Z",
"updated_at": "2022-09-04T14:38:08.962623Z",
"structure_string": "Nd2 Ta2 O8\n1.0\n0.000000 5.275225 -0.002576\n5.625124 0.000000 0.000000\n0.000000 -0.646723 -5.429802\nNd Ta O\n2 2 8\ndirect\n0.000000 0.764033 0.250000 Nd\n0.000000 0.235967 0.750000 Nd\n0.500001 0.688012 0.750000 Ta\n0.500001 0.311987 0.250000 Ta\n0.274337 0.561374 0.990556 O\n0.725665 0.561374 0.509444 O\n0.725664 0.438626 0.009444 O\n0.274337 0.438626 0.490556 O\n0.743612 0.091344 0.390125 O\n0.256390 0.091344 0.109876 O\n0.256390 0.908655 0.609876 O\n0.743612 0.908655 0.890125 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Nd",
"Ta",
"O"
],
"chemical_system": "Nd-O-Ta",
"density": 8.021500475739543,
"density_atomic": 0.07447300975047434,
"volume": 161.13220131973475,
"volume_molar": 8.08633997763417,
"formula_full": "Nd2 Ta2 O8",
"formula_reduced": "NdTaO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.752089116666667,
"spacegroup": 13
},
{
"id": "jvasp-17687",
"created_at": "2022-09-04T14:38:26.825956Z",
"updated_at": "2022-09-04T14:38:26.825977Z",
"structure_string": "Sm3 Ga1\n1.0\n4.759427 0.000000 0.000000\n0.000000 4.759427 0.000000\n-0.000000 -0.000000 4.759427\nSm Ga\n3 1\ndirect\n0.500000 0.500000 0.000000 Sm\n0.500000 0.000000 0.500000 Sm\n0.000000 0.500000 0.500000 Sm\n0.000000 0.000000 0.000000 Ga\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sm",
"Ga"
],
"chemical_system": "Ga-Sm",
"density": 8.02155498329687,
"density_atomic": 0.037101885542277634,
"volume": 107.81123227394995,
"volume_molar": 16.23136040656954,
"formula_full": "Sm3 Ga1",
"formula_reduced": "Sm3Ga",
"formula_anonymous": "AB3",
"energy_above_hull": 0.9991884166666666,
"spacegroup": 221
},
{
"id": "jvasp-17571",
"created_at": "2022-09-04T14:37:33.281319Z",
"updated_at": "2022-09-04T14:37:33.281349Z",
"structure_string": "Sm1 In3\n1.0\n4.678891 0.000000 0.000000\n0.000000 4.678891 0.000000\n0.000000 -0.000000 4.678891\nSm In\n1 3\ndirect\n0.000000 0.000000 0.000000 Sm\n0.500000 0.000000 0.500000 In\n0.000000 0.500000 0.500000 In\n0.500000 0.500000 0.000000 In\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sm",
"In"
],
"chemical_system": "In-Sm",
"density": 8.021623837089082,
"density_atomic": 0.039050914394027456,
"volume": 102.4303799813653,
"volume_molar": 15.421254158701702,
"formula_full": "Sm1 In3",
"formula_reduced": "SmIn3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-93866",
"created_at": "2022-09-04T14:36:04.095731Z",
"updated_at": "2022-09-04T14:36:04.095751Z",
"structure_string": "Ce2 In2 Cu2\n1.0\n-2.404160 -4.163978 -0.000000\n-2.404160 4.163978 0.000000\n0.000000 0.000000 -6.585614\nCe In Cu\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Ce\n0.000000 0.000000 0.000000 Ce\n0.666661 0.333339 0.250000 In\n0.333339 0.666661 0.750000 In\n0.666671 0.333330 0.750000 Cu\n0.333330 0.666671 0.250000 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"In",
"Cu"
],
"chemical_system": "Ce-Cu-In",
"density": 8.021640536541288,
"density_atomic": 0.04550437872444195,
"volume": 131.85544266704153,
"volume_molar": 13.234200595217231,
"formula_full": "Ce2 In2 Cu2",
"formula_reduced": "CeInCu",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2852586399999999,
"spacegroup": 194
},
{
"id": "jvasp-74449",
"created_at": "2022-09-04T14:36:00.442306Z",
"updated_at": "2022-09-04T14:36:00.442338Z",
"structure_string": "Be1 Cu4 Tc1\n1.0\n-0.000000 3.343703 3.343703\n3.343703 -0.000000 3.343703\n3.343703 3.343703 -0.000000\nBe Cu Tc\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.374813 0.374813 0.374813 Cu\n0.374813 0.875558 0.374813 Cu\n0.374813 0.374813 0.875558 Cu\n0.875558 0.374813 0.374813 Cu\n0.749999 0.749999 0.749999 Tc\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Cu",
"Tc"
],
"chemical_system": "Be-Cu-Tc",
"density": 8.021935546376643,
"density_atomic": 0.08024873038877627,
"volume": 74.76753801502099,
"volume_molar": 7.504343970085123,
"formula_full": "Be1 Cu4 Tc1",
"formula_reduced": "BeCu4Tc",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.1046382333333338,
"spacegroup": 216
},
{
"id": "jvasp-78358",
"created_at": "2022-09-04T14:38:04.003349Z",
"updated_at": "2022-09-04T14:38:04.003378Z",
"structure_string": "Ce1 N1\n1.0\n-2.517291 -2.517291 -0.000000\n-2.517291 0.000000 -2.517291\n0.000000 -2.517291 -2.517291\nCe N\n1 1\ndirect\n0.000000 0.000000 0.000000 Ce\n0.500000 0.500000 0.500000 N\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ce",
"N"
],
"chemical_system": "Ce-N",
"density": 8.022051414701806,
"density_atomic": 0.06269021087741947,
"volume": 31.902907519495752,
"volume_molar": 9.606189986783294,
"formula_full": "Ce1 N1",
"formula_reduced": "CeN",
"formula_anonymous": "AB",
"energy_above_hull": 1.607019375,
"spacegroup": 225
},
{
"id": "jvasp-14575",
"created_at": "2022-09-04T14:35:46.241022Z",
"updated_at": "2022-09-04T14:35:46.241048Z",
"structure_string": "Ce1 N1\n1.0\n3.083025 -0.000000 1.779986\n1.027675 2.906704 1.779986\n-0.000000 -0.000000 3.559970\nCe N\n1 1\ndirect\n0.000000 0.000000 0.000000 Ce\n0.500002 0.499999 0.500001 N\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ce",
"N"
],
"chemical_system": "Ce-N",
"density": 8.02216357599124,
"density_atomic": 0.06269108738824238,
"volume": 31.90246147134301,
"volume_molar": 9.606055678545216,
"formula_full": "Ce1 N1",
"formula_reduced": "CeN",
"formula_anonymous": "AB",
"energy_above_hull": 1.607019375,
"spacegroup": 225
},
{
"id": "jvasp-38390",
"created_at": "2022-09-04T14:37:57.117098Z",
"updated_at": "2022-09-04T14:37:57.117123Z",
"structure_string": "Pr3 Hf1\n1.0\n4.992611 -0.000000 -0.000000\n0.000000 4.992611 0.000000\n-0.000000 -0.000000 4.992611\nPr Hf\n3 1\ndirect\n0.500000 0.000000 0.500000 Pr\n0.000000 0.500000 0.500000 Pr\n0.500000 0.500000 0.000000 Pr\n0.000000 0.000000 0.000000 Hf\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pr",
"Hf"
],
"chemical_system": "Hf-Pr",
"density": 8.022213876490902,
"density_atomic": 0.03214228914247352,
"volume": 124.4466435563954,
"volume_molar": 18.735880115154004,
"formula_full": "Pr3 Hf1",
"formula_reduced": "Pr3Hf",
"formula_anonymous": "AB3",
"energy_above_hull": 2.6834531375,
"spacegroup": 221
},
{
"id": "jvasp-8008",
"created_at": "2022-09-04T14:37:04.647311Z",
"updated_at": "2022-09-04T14:37:04.647325Z",
"structure_string": "Ni4 B2\n1.0\n3.970330 0.016132 -1.102886\n-2.290246 3.243232 -1.102886\n-0.008315 -0.016132 4.120657\nNi B\n4 2\ndirect\n0.919663 0.580335 -0.000002 Ni\n0.080335 0.080336 0.660672 Ni\n0.580335 0.919663 -0.000002 Ni\n0.419663 0.419664 0.339327 Ni\n0.499999 0.000000 0.500000 B\n-0.000001 0.500000 0.500000 B\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ni",
"B"
],
"chemical_system": "B-Ni",
"density": 8.02225400959878,
"density_atomic": 0.11305453652474586,
"volume": 53.071731435444825,
"volume_molar": 5.326757284686094,
"formula_full": "Ni4 B2",
"formula_reduced": "Ni2B",
"formula_anonymous": "AB2",
"energy_above_hull": 1.855992461111111,
"spacegroup": 140
}
]
}