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=-formula_anonymous&page=477",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=475",
"results": [
{
"id": "jvasp-66630",
"created_at": "2022-09-04T14:36:15.480494Z",
"updated_at": "2022-09-04T14:36:15.480522Z",
"structure_string": "Ba4 Ge1 Mo1\n1.0\n-0.000000 4.899182 4.899182\n4.899182 0.000000 4.899182\n4.899182 4.899182 0.000000\nBa Ge Mo\n4 1 1\ndirect\n0.127083 0.624305 0.624305 Ba\n0.624305 0.624305 0.624305 Ba\n0.624305 0.127083 0.624305 Ba\n0.624305 0.624305 0.127083 Ba\n0.250000 0.250000 0.250000 Ge\n0.000000 0.000000 0.000000 Mo\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Ge",
"Mo"
],
"chemical_system": "Ba-Ge-Mo",
"density": 5.068799065399616,
"density_atomic": 0.025512354127558954,
"volume": 235.18017859115088,
"volume_molar": 23.60480232396415,
"formula_full": "Ba4 Ge1 Mo1",
"formula_reduced": "Ba4GeMo",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.2450226216666664,
"spacegroup": 216
},
{
"id": "jvasp-64574",
"created_at": "2022-09-04T14:36:16.078144Z",
"updated_at": "2022-09-04T14:36:16.078169Z",
"structure_string": "Ba4 In1 Bi1\n1.0\n0.000000 5.036332 5.036332\n5.036332 -0.000000 5.036332\n5.036332 5.036332 0.000000\nBa In Bi\n4 1 1\ndirect\n0.127513 0.624162 0.624162 Ba\n0.624162 0.624162 0.624162 Ba\n0.624162 0.127513 0.624162 Ba\n0.624162 0.624162 0.127513 Ba\n0.000000 0.000000 0.000000 In\n0.250000 0.250000 0.250000 Bi\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"In",
"Bi"
],
"chemical_system": "Ba-Bi-In",
"density": 5.674704076855914,
"density_atomic": 0.023484331394649217,
"volume": 255.48949634423354,
"volume_molar": 25.643228494774664,
"formula_full": "Ba4 In1 Bi1",
"formula_reduced": "Ba4InBi",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-43597",
"created_at": "2022-09-04T14:36:09.560808Z",
"updated_at": "2022-09-04T14:36:09.560825Z",
"structure_string": "Li4 Mn4 F16\n1.0\n6.285638 -0.000000 0.000000\n0.000000 6.305176 0.000000\n0.000000 0.000000 6.555029\nLi Mn F\n4 4 16\ndirect\n0.249979 0.250000 0.250034 Li\n0.250021 0.750000 0.750034 Li\n0.749979 0.250000 0.249966 Li\n0.750021 0.750000 0.749966 Li\n-0.000007 0.250000 0.749916 Mn\n0.500007 0.750000 0.249916 Mn\n0.499993 0.250000 0.750084 Mn\n0.000007 0.750000 0.250084 Mn\n0.750055 0.250000 0.945738 F\n0.750062 0.750000 0.054257 F\n0.749938 0.250000 0.554257 F\n0.749946 0.750000 0.445738 F\n0.500002 0.540216 0.750085 F\n0.500002 0.959785 0.750085 F\n0.499998 0.459785 0.249915 F\n0.249938 0.250000 0.945743 F\n0.250055 0.250000 0.554262 F\n0.250062 0.750000 0.445743 F\n0.999998 0.459785 0.250085 F\n0.249946 0.750000 0.054262 F\n0.000002 0.540216 0.749915 F\n0.000002 0.959785 0.749915 F\n0.499998 0.040216 0.249915 F\n0.999998 0.040216 0.250085 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Li",
"Mn",
"F"
],
"chemical_system": "F-Li-Mn",
"density": 3.5250561532929705,
"density_atomic": 0.09238257108308452,
"volume": 259.78926239685984,
"volume_molar": 6.5186979420436035,
"formula_full": "Li4 Mn4 F16",
"formula_reduced": "LiMnF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.3466213952298851,
"spacegroup": 65
},
{
"id": "jvasp-66359",
"created_at": "2022-09-04T14:36:16.443067Z",
"updated_at": "2022-09-04T14:36:16.443086Z",
"structure_string": "Ba4 Re1 Br1\n1.0\n-0.000000 4.809468 4.809468\n4.809468 -0.000000 4.809468\n4.809468 4.809468 0.000000\nBa Re Br\n4 1 1\ndirect\n0.121824 0.626059 0.626059 Ba\n0.626059 0.626059 0.626059 Ba\n0.626059 0.121824 0.626059 Ba\n0.626059 0.626059 0.121824 Ba\n0.000000 0.000000 0.000000 Re\n0.250000 0.250000 0.250000 Br\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Re",
"Br"
],
"chemical_system": "Ba-Br-Re",
"density": 6.0856757637417,
"density_atomic": 0.026966844835578815,
"volume": 222.49543973657148,
"volume_molar": 22.331647609195514,
"formula_full": "Ba4 Re1 Br1",
"formula_reduced": "Ba4ReBr",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.2358359974999995,
"spacegroup": 216
},
{
"id": "jvasp-98385",
"created_at": "2022-09-04T14:36:16.222867Z",
"updated_at": "2022-09-04T14:36:16.222886Z",
"structure_string": "La2 Nb2 O8\n1.0\n-0.106052 0.000000 5.249102\n5.585903 -0.000000 -0.294635\n-2.739926 5.786858 -2.477234\nLa Nb O\n2 2 8\ndirect\n0.379400 0.129399 0.758800 La\n0.620601 0.870600 0.241201 La\n0.854116 0.604114 0.708230 Nb\n0.145886 0.395885 0.291771 Nb\n0.803437 0.142751 0.087553 O\n0.284116 0.444801 0.087553 O\n0.196564 0.857248 0.912447 O\n0.715885 0.555198 0.912447 O\n0.581951 0.771371 0.564652 O\n0.982702 0.293280 0.564652 O\n0.418050 0.228628 0.435348 O\n0.017299 0.706719 0.435348 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"La",
"Nb",
"O"
],
"chemical_system": "La-Nb-O",
"density": 5.796061342646216,
"density_atomic": 0.07079834117078901,
"volume": 169.49549666781078,
"volume_molar": 8.50604782599723,
"formula_full": "La2 Nb2 O8",
"formula_reduced": "LaNbO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.591268066666667,
"spacegroup": 15
},
{
"id": "jvasp-64571",
"created_at": "2022-09-04T14:36:15.545250Z",
"updated_at": "2022-09-04T14:36:15.545274Z",
"structure_string": "Ba4 Cr1 Cl1\n1.0\n0.000000 5.164151 5.164151\n5.164151 0.000000 5.164151\n5.164151 5.164151 0.000000\nBa Cr Cl\n4 1 1\ndirect\n0.122409 0.625863 0.625863 Ba\n0.625863 0.625863 0.625863 Ba\n0.625863 0.122409 0.625863 Ba\n0.625863 0.625863 0.122409 Ba\n0.000000 0.000000 0.000000 Cr\n0.250000 0.250000 0.250000 Cl\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Cr",
"Cl"
],
"chemical_system": "Ba-Cl-Cr",
"density": 3.838805428261666,
"density_atomic": 0.02178333934296095,
"volume": 275.43986280224914,
"volume_molar": 27.64562707850387,
"formula_full": "Ba4 Cr1 Cl1",
"formula_reduced": "Ba4CrCl",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.7976575579166666,
"spacegroup": 216
},
{
"id": "jvasp-71079",
"created_at": "2022-09-04T14:36:09.574936Z",
"updated_at": "2022-09-04T14:36:09.574969Z",
"structure_string": "Be1 P4 Pt1\n1.0\n0.000000 3.570853 3.570853\n3.570853 0.000000 3.570853\n3.570853 3.570853 -0.000000\nBe P Pt\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.115979 0.628006 0.628006 P\n0.628006 0.628006 0.628006 P\n0.628006 0.115979 0.628006 P\n0.628006 0.628006 0.115979 P\n0.250000 0.250000 0.250000 Pt\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"P",
"Pt"
],
"chemical_system": "Be-P-Pt",
"density": 5.9808845181225,
"density_atomic": 0.065887850324325,
"volume": 91.06382998482609,
"volume_molar": 9.139986705222189,
"formula_full": "Be1 P4 Pt1",
"formula_reduced": "BeP4Pt",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.1767682500000003,
"spacegroup": 216
},
{
"id": "jvasp-70810",
"created_at": "2022-09-04T14:36:16.815169Z",
"updated_at": "2022-09-04T14:36:16.815177Z",
"structure_string": "Be1 Co4 Sb1\n1.0\n0.000000 3.355738 3.355738\n3.355738 0.000000 3.355738\n3.355738 3.355738 0.000000\nBe Co Sb\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.122626 0.625792 0.625792 Co\n0.625792 0.625792 0.625792 Co\n0.625792 0.122626 0.625792 Co\n0.625792 0.625792 0.122626 Co\n0.250000 0.250000 0.250000 Sb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Co",
"Sb"
],
"chemical_system": "Be-Co-Sb",
"density": 8.052575827678124,
"density_atomic": 0.07938841242472931,
"volume": 75.57778039318762,
"volume_molar": 7.5856671976024,
"formula_full": "Be1 Co4 Sb1",
"formula_reduced": "BeCo4Sb",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.1213276333333333,
"spacegroup": 216
},
{
"id": "jvasp-66088",
"created_at": "2022-09-04T14:36:16.813812Z",
"updated_at": "2022-09-04T14:36:16.813834Z",
"structure_string": "Ba4 Bi1 Ir1\n1.0\n-0.000000 4.801239 4.801239\n4.801239 -0.000000 4.801239\n4.801239 4.801239 -0.000000\nBa Bi Ir\n4 1 1\ndirect\n0.123548 0.625484 0.625484 Ba\n0.625484 0.625484 0.625484 Ba\n0.625484 0.123548 0.625484 Ba\n0.625484 0.625484 0.123548 Ba\n0.250000 0.250000 0.250000 Bi\n0.000000 0.000000 0.000000 Ir\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Bi",
"Ir"
],
"chemical_system": "Ba-Bi-Ir",
"density": 7.130397065772038,
"density_atomic": 0.027105740684656453,
"volume": 221.35532357528882,
"volume_molar": 22.21721527576226,
"formula_full": "Ba4 Bi1 Ir1",
"formula_reduced": "Ba4BiIr",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.9206098799999995,
"spacegroup": 216
},
{
"id": "jvasp-64226",
"created_at": "2022-09-04T14:36:16.790719Z",
"updated_at": "2022-09-04T14:36:16.790750Z",
"structure_string": "Ba4 Ga1 Sn1\n1.0\n-0.000000 4.990606 4.990606\n4.990606 -0.000000 4.990606\n4.990606 4.990606 0.000000\nBa Ga Sn\n4 1 1\ndirect\n0.123171 0.625610 0.625610 Ba\n0.625610 0.625610 0.625610 Ba\n0.625610 0.123171 0.625610 Ba\n0.625610 0.625610 0.123171 Ba\n0.250000 0.250000 0.250000 Ga\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Ga",
"Sn"
],
"chemical_system": "Ba-Ga-Sn",
"density": 4.927914551408868,
"density_atomic": 0.024135783500246342,
"volume": 248.5935457590909,
"volume_molar": 24.951088743145775,
"formula_full": "Ba4 Ga1 Sn1",
"formula_reduced": "Ba4GaSn",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-65207",
"created_at": "2022-09-04T14:36:17.612633Z",
"updated_at": "2022-09-04T14:36:17.612652Z",
"structure_string": "Be1 Te1 Cl4\n1.0\n0.000000 4.123855 4.123855\n4.123855 0.000000 4.123855\n4.123855 4.123855 -0.000000\nBe Te Cl\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Te\n0.124682 0.625107 0.625107 Cl\n0.625107 0.625107 0.625107 Cl\n0.625107 0.124682 0.625107 Cl\n0.625107 0.625107 0.124682 Cl\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Te",
"Cl"
],
"chemical_system": "Be-Cl-Te",
"density": 3.2962177567328568,
"density_atomic": 0.04277707598009545,
"volume": 140.2620413511165,
"volume_molar": 14.077962605022735,
"formula_full": "Be1 Te1 Cl4",
"formula_reduced": "BeTeCl4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.7240950227777778,
"spacegroup": 216
},
{
"id": "jvasp-66269",
"created_at": "2022-09-04T14:36:09.228510Z",
"updated_at": "2022-09-04T14:36:09.228537Z",
"structure_string": "Ba4 Mo1 Pb1\n1.0\n0.000000 4.973213 4.973213\n4.973213 0.000000 4.973213\n4.973213 4.973213 -0.000000\nBa Mo Pb\n4 1 1\ndirect\n0.123531 0.625489 0.625489 Ba\n0.625489 0.625489 0.625489 Ba\n0.625489 0.123531 0.625489 Ba\n0.625489 0.625489 0.123531 Ba\n0.250000 0.250000 0.250000 Mo\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Mo",
"Pb"
],
"chemical_system": "Ba-Mo-Pb",
"density": 5.754078961506429,
"density_atomic": 0.024389903052611732,
"volume": 246.0034378594016,
"volume_molar": 24.69112217055383,
"formula_full": "Ba4 Mo1 Pb1",
"formula_reduced": "Ba4MoPb",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.1172384333333332,
"spacegroup": 216
}
]
}