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=-created_at&page=3621",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=3619",
"results": [
{
"id": "jvasp-69415",
"created_at": "2022-09-04T14:36:14.784208Z",
"updated_at": "2022-09-04T14:36:14.784219Z",
"structure_string": "Zr1 Be2 Se1\n1.0\n-1.843329 1.843329 4.556981\n1.843329 -1.843329 4.556981\n1.843329 1.843329 -4.556981\nZr Be Se\n1 2 1\ndirect\n0.750000 0.250000 0.500000 Zr\n0.000000 0.000000 0.000000 Be\n0.500000 0.500000 0.000000 Be\n0.250000 0.750000 0.500000 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Be",
"Se"
],
"chemical_system": "Be-Se-Zr",
"density": 5.045975024951058,
"density_atomic": 0.0645828298729616,
"volume": 61.93596669375198,
"volume_molar": 9.324677738411157,
"formula_full": "Zr1 Be2 Se1",
"formula_reduced": "ZrBe2Se",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.3497050166666664,
"spacegroup": 139
},
{
"id": "jvasp-93379",
"created_at": "2022-09-04T14:36:14.779385Z",
"updated_at": "2022-09-04T14:36:14.779420Z",
"structure_string": "B2 Pt4\n1.0\n-1.518980 -2.483398 -0.000000\n-1.518980 2.483398 0.000000\n0.000000 -0.000000 -10.401619\nB Pt\n2 4\ndirect\n0.673259 0.326741 0.750000 B\n0.326741 0.673259 0.250000 B\n0.669979 0.330021 0.115936 Pt\n0.330021 0.669979 0.884064 Pt\n0.330021 0.669979 0.615936 Pt\n0.669979 0.330021 0.384064 Pt\n",
"nsites": 6,
"nelements": 2,
"elements": [
"B",
"Pt"
],
"chemical_system": "B-Pt",
"density": 16.969592019774062,
"density_atomic": 0.07645782334099885,
"volume": 78.47463788290491,
"volume_molar": 7.876421923681364,
"formula_full": "B2 Pt4",
"formula_reduced": "BPt2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.827461794444445,
"spacegroup": 63
},
{
"id": "jvasp-92182",
"created_at": "2022-09-04T14:36:14.773221Z",
"updated_at": "2022-09-04T14:36:14.773241Z",
"structure_string": "Rb3 Na1 H4\n1.0\n5.775689 -0.000000 -0.000000\n-0.000000 5.775689 0.000000\n-0.000000 -0.000000 5.775689\nRb Na H\n3 1 4\ndirect\n0.000000 0.000000 0.500000 Rb\n0.000000 0.500000 0.000000 Rb\n0.500000 0.000000 0.000000 Rb\n0.500000 0.500000 0.500000 Na\n0.500000 0.500000 0.000000 H\n0.500000 0.000000 0.500000 H\n0.000000 0.500000 0.500000 H\n0.000000 0.000000 0.000000 H\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Rb",
"Na",
"H"
],
"chemical_system": "H-Na-Rb",
"density": 2.4427315650214254,
"density_atomic": 0.0415220308697829,
"volume": 192.6688033417434,
"volume_molar": 14.503483172309213,
"formula_full": "Rb3 Na1 H4",
"formula_reduced": "Rb3NaH4",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.958857375,
"spacegroup": 221
},
{
"id": "jvasp-69225",
"created_at": "2022-09-04T14:36:14.771199Z",
"updated_at": "2022-09-04T14:36:14.771224Z",
"structure_string": "Ba1 Sr2 Bi1\n1.0\n4.328921 0.000000 0.000000\n0.000000 4.328921 -0.000000\n-0.000000 -0.000000 9.800223\nBa Sr Bi\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.676394 Sr\n0.000000 0.000000 0.323606 Sr\n0.500000 0.500000 0.500000 Bi\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Sr",
"Bi"
],
"chemical_system": "Ba-Bi-Sr",
"density": 4.7157155809199685,
"density_atomic": 0.021780342896725556,
"volume": 183.65183775877824,
"volume_molar": 27.649430445401137,
"formula_full": "Ba1 Sr2 Bi1",
"formula_reduced": "BaSr2Bi",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 123
},
{
"id": "jvasp-93506",
"created_at": "2022-09-04T14:36:14.770852Z",
"updated_at": "2022-09-04T14:36:14.770871Z",
"structure_string": "Nd1 Ni5\n1.0\n0.000000 0.000000 -3.959272\n-2.480123 -4.295698 0.000000\n-2.480509 4.295921 0.000000\nNd Ni\n1 5\ndirect\n0.000000 0.999980 -0.000001 Nd\n0.000000 0.333287 0.666619 Ni\n0.000000 0.666668 0.333381 Ni\n0.500000 0.499991 -0.000000 Ni\n0.500000 0.499989 0.500002 Ni\n0.500000 0.999986 0.499997 Ni\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Nd",
"Ni"
],
"chemical_system": "Nd-Ni",
"density": 8.614641554685326,
"density_atomic": 0.07111380034295171,
"volume": 84.3718092840566,
"volume_molar": 8.468315194741061,
"formula_full": "Nd1 Ni5",
"formula_reduced": "NdNi5",
"formula_anonymous": "AB5",
"energy_above_hull": 1.2086055833333331,
"spacegroup": 191
},
{
"id": "jvasp-69661",
"created_at": "2022-09-04T14:36:14.770105Z",
"updated_at": "2022-09-04T14:36:14.770139Z",
"structure_string": "Be2 In1 Cu1\n1.0\n2.979301 -0.000000 -0.000000\n0.000000 2.979301 -0.000000\n0.000000 0.000000 5.956016\nBe In Cu\n2 1 1\ndirect\n-0.000000 -0.000000 0.317355 Be\n-0.000000 -0.000000 0.682645 Be\n0.500000 0.500000 0.000000 In\n0.500000 0.500000 0.500000 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"In",
"Cu"
],
"chemical_system": "Be-Cu-In",
"density": 6.1685093767064405,
"density_atomic": 0.07566157383691731,
"volume": 52.86699439561873,
"volume_molar": 7.95931204521368,
"formula_full": "Be2 In1 Cu1",
"formula_reduced": "Be2InCu",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.7806132881250001,
"spacegroup": 123
},
{
"id": "jvasp-71130",
"created_at": "2022-09-04T14:36:14.768825Z",
"updated_at": "2022-09-04T14:36:14.768858Z",
"structure_string": "Be2 P1 Se1\n1.0\n3.242639 -2.651387 0.000000\n3.242639 2.651387 0.000000\n0.000000 0.000000 3.175170\nBe P Se\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.500000 0.500000 0.000000 Be\n0.500000 -0.000000 0.500000 P\n-0.000000 0.500000 0.500000 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"P",
"Se"
],
"chemical_system": "Be-P-Se",
"density": 3.8917798571563496,
"density_atomic": 0.07326411177615248,
"volume": 54.59699030026326,
"volume_molar": 8.2197690165135,
"formula_full": "Be2 P1 Se1",
"formula_reduced": "Be2PSe",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.1523627666666667,
"spacegroup": 65
},
{
"id": "jvasp-99529",
"created_at": "2022-09-04T14:36:14.762450Z",
"updated_at": "2022-09-04T14:36:14.762474Z",
"structure_string": "Sr2 Cu1 S2 Cl2\n1.0\n4.405356 -0.004299 -7.377230\n-0.338915 4.392302 -7.377230\n0.003984 0.004299 8.592477\nSr Cu S Cl\n2 1 2 2\ndirect\n0.374283 0.374283 -0.000000 Sr\n0.625717 0.625717 -0.000000 Sr\n0.000000 0.000000 0.000000 Cu\n0.500000 -0.000000 0.500000 S\n-0.000001 0.500000 0.499999 S\n0.189565 0.189565 -0.000000 Cl\n0.810435 0.810434 -0.000001 Cl\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Sr",
"Cu",
"S",
"Cl"
],
"chemical_system": "Cl-Cu-S-Sr",
"density": 3.7275636612018834,
"density_atomic": 0.042034816429111575,
"volume": 166.52862066865336,
"volume_molar": 14.326554203361082,
"formula_full": "Sr2 Cu1 S2 Cl2",
"formula_reduced": "Sr2Cu(SCl)2",
"formula_anonymous": "AB2C2D2",
"energy_above_hull": 0.142854457857143,
"spacegroup": 139
},
{
"id": "jvasp-70017",
"created_at": "2022-09-04T14:36:14.758411Z",
"updated_at": "2022-09-04T14:36:14.758421Z",
"structure_string": "Be2 Cu1 Cl1\n1.0\n2.964917 0.000000 -0.000000\n-0.000000 2.964917 -0.000000\n-0.000000 0.000000 6.736483\nBe Cu Cl\n2 1 1\ndirect\n0.000000 0.000000 -0.001897 Be\n0.500001 0.500001 0.219643 Be\n0.500001 0.500001 0.900147 Cu\n0.000000 0.000000 0.382105 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Cu",
"Cl"
],
"chemical_system": "Be-Cl-Cu",
"density": 3.281431760454806,
"density_atomic": 0.06754631993871756,
"volume": 59.218622178514856,
"volume_molar": 8.915571959306858,
"formula_full": "Be2 Cu1 Cl1",
"formula_reduced": "Be2CuCl",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.873316679375,
"spacegroup": 99
},
{
"id": "jvasp-69885",
"created_at": "2022-09-04T14:36:14.746404Z",
"updated_at": "2022-09-04T14:36:14.746429Z",
"structure_string": "Be1 Ge2 Te1\n1.0\n0.000000 3.463407 3.463407\n3.463407 0.000000 3.463407\n3.463407 3.463407 -0.000000\nBe Ge Te\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Ge\n0.750001 0.750001 0.750001 Ge\n0.500000 0.500000 0.500000 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Ge",
"Te"
],
"chemical_system": "Be-Ge-Te",
"density": 5.633671789864395,
"density_atomic": 0.04814147634066544,
"volume": 83.08843650108777,
"volume_molar": 12.50925650344681,
"formula_full": "Be1 Ge2 Te1",
"formula_reduced": "BeGe2Te",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.2705514416666666,
"spacegroup": 225
},
{
"id": "jvasp-64967",
"created_at": "2022-09-04T14:36:14.741792Z",
"updated_at": "2022-09-04T14:36:14.741817Z",
"structure_string": "Ca1 Ti1 Be2\n1.0\n-2.026799 2.026799 3.952646\n2.026799 -2.026799 3.952646\n2.026799 2.026799 -3.952646\nCa Ti Be\n1 1 2\ndirect\n0.500000 0.500000 0.000000 Ca\n0.750000 0.250000 0.500000 Ti\n0.000000 0.000000 0.000000 Be\n0.250000 0.750000 0.500000 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Ti",
"Be"
],
"chemical_system": "Be-Ca-Ti",
"density": 2.7093190503686664,
"density_atomic": 0.061587236442064784,
"volume": 64.94852230888468,
"volume_molar": 9.778228587452594,
"formula_full": "Ca1 Ti1 Be2",
"formula_reduced": "CaTiBe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.9187927383333332,
"spacegroup": 119
},
{
"id": "jvasp-18491",
"created_at": "2022-09-04T14:36:14.740286Z",
"updated_at": "2022-09-04T14:36:14.740310Z",
"structure_string": "Sc2 N1 Cl2\n1.0\n1.678916 -2.907967 -0.000000\n1.678916 2.907967 0.000000\n-0.000000 -0.000000 8.821848\nSc N Cl\n2 1 2\ndirect\n0.666668 0.333334 0.634578 Sc\n0.333334 0.666668 0.365423 Sc\n0.000000 0.000000 0.500000 N\n0.666668 0.333334 0.174788 Cl\n0.333334 0.666668 0.825212 Cl\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sc",
"N",
"Cl"
],
"chemical_system": "Cl-N-Sc",
"density": 3.370105091584893,
"density_atomic": 0.05804462320323698,
"volume": 86.14062292200674,
"volume_molar": 10.375019127808143,
"formula_full": "Sc2 N1 Cl2",
"formula_reduced": "Sc2NCl2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.819940377,
"spacegroup": 164
}
]
}