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_reduced&page=408",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_reduced&page=406",
"results": [
{
"id": "jvasp-11441",
"created_at": "2022-09-04T14:37:16.550005Z",
"updated_at": "2022-09-04T14:37:16.550020Z",
"structure_string": "Ba2 Nd4 Zn2 S10\n1.0\n7.054693 0.000000 -3.520565\n-1.756899 6.832423 -3.520565\n-0.001661 -0.002142 8.825236\nBa Nd Zn S\n2 4 2 10\ndirect\n0.250000 0.250000 0.500000 Ba\n0.750000 0.750000 0.499999 Ba\n0.338746 0.161254 -0.000000 Nd\n0.161254 0.661254 -0.000001 Nd\n0.661253 0.838746 -0.000001 Nd\n0.838746 0.338746 -0.000001 Nd\n0.250000 0.750000 0.500000 Zn\n0.750000 0.250000 0.500000 Zn\n0.500000 0.500000 -0.000001 S\n0.484204 0.984204 0.268323 S\n0.984204 0.784118 0.268322 S\n0.284118 0.484204 0.268323 S\n0.015796 0.215882 0.731677 S\n0.715881 0.515796 0.731676 S\n0.515796 0.015796 0.731677 S\n0.215881 0.715882 0.731676 S\n0.784118 0.284118 0.268323 S\n0.000000 0.000000 0.000000 S\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Ba",
"Nd",
"Zn",
"S"
],
"chemical_system": "Ba-Nd-S-Zn",
"density": 5.088068640681495,
"density_atomic": 0.042325486351953066,
"volume": 425.27568024435493,
"volume_molar": 14.228166712423649,
"formula_full": "Ba2 Nd4 Zn2 S10",
"formula_reduced": "BaNd2ZnS5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 1.2191421522222223,
"spacegroup": 140
},
{
"id": "jvasp-90337",
"created_at": "2022-09-04T14:35:50.951040Z",
"updated_at": "2022-09-04T14:35:50.951073Z",
"structure_string": "Ba1 Nd1 Co2 O5\n1.0\n-0.000000 -3.915127 0.000000\n-3.914882 0.000000 0.000000\n0.000000 0.000000 -7.515348\nBa Nd Co O\n1 1 2 5\ndirect\n0.500000 0.500000 0.500000 Ba\n0.500000 0.500000 0.000000 Nd\n0.000000 0.000000 0.759118 Co\n0.000000 0.000000 0.240882 Co\n0.500000 0.000000 0.797726 O\n0.500000 0.000000 0.202274 O\n0.000000 0.500000 0.797716 O\n0.000000 0.500000 0.202284 O\n0.000000 0.000000 0.500000 O\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Ba",
"Nd",
"Co",
"O"
],
"chemical_system": "Ba-Co-Nd-O",
"density": 6.911349294388069,
"density_atomic": 0.07813198953046017,
"volume": 115.18969443996178,
"volume_molar": 7.707650600209326,
"formula_full": "Ba1 Nd1 Co2 O5",
"formula_reduced": "BaNdCo2O5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 2.387610752222222,
"spacegroup": 123
},
{
"id": "jvasp-90350",
"created_at": "2022-09-04T14:36:21.451575Z",
"updated_at": "2022-09-04T14:36:21.451603Z",
"structure_string": "Ba1 Nd1 Co2 O5\n1.0\n-0.000000 -3.915068 0.000000\n-3.914994 -0.000000 0.000000\n0.000000 0.000000 -7.515269\nBa Nd Co O\n1 1 2 5\ndirect\n0.500000 0.499999 0.500000 Ba\n0.500000 0.499999 0.000000 Nd\n0.000000 0.000000 0.759138 Co\n0.000000 0.000000 0.240862 Co\n0.500000 0.000000 0.797721 O\n0.500000 0.000000 0.202279 O\n0.000000 0.499999 0.797724 O\n0.000000 0.499999 0.202277 O\n0.000000 0.000000 0.500000 O\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Ba",
"Nd",
"Co",
"O"
],
"chemical_system": "Ba-Co-Nd-O",
"density": 6.911328376344875,
"density_atomic": 0.07813175305444628,
"volume": 115.19004307670315,
"volume_molar": 7.707673928426332,
"formula_full": "Ba1 Nd1 Co2 O5",
"formula_reduced": "BaNdCo2O5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 2.387612974444444,
"spacegroup": 123
},
{
"id": "jvasp-8612",
"created_at": "2022-09-04T14:37:09.824606Z",
"updated_at": "2022-09-04T14:37:09.824626Z",
"structure_string": "Ba1 Nd1 Co2 O5\n1.0\n3.914817 -0.000000 0.000000\n0.000000 3.915295 0.000000\n0.000000 0.000000 7.515134\nBa Nd Co O\n1 1 2 5\ndirect\n0.500000 0.499999 0.500000 Ba\n0.500000 0.499999 0.000000 Nd\n0.000000 0.000000 0.759115 Co\n0.000000 0.000000 0.240885 Co\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.797728 O\n0.500000 0.000000 0.202271 O\n0.000000 0.499999 0.797697 O\n0.000000 0.499999 0.202302 O\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Ba",
"Nd",
"Co",
"O"
],
"chemical_system": "Ba-Co-Nd-O",
"density": 6.911364287543966,
"density_atomic": 0.07813215902632122,
"volume": 115.18944455340181,
"volume_molar": 7.707633879631123,
"formula_full": "Ba1 Nd1 Co2 O5",
"formula_reduced": "BaNdCo2O5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 2.387609641111111,
"spacegroup": 123
},
{
"id": "jvasp-111140",
"created_at": "2022-09-04T14:38:37.742370Z",
"updated_at": "2022-09-04T14:38:37.742400Z",
"structure_string": "Ba1 Nd1 Co2 O6\n1.0\n3.880007 0.000000 0.000000\n0.000000 3.880007 0.000000\n0.000000 0.000000 7.649267\nBa Nd Co O\n1 1 2 6\ndirect\n0.000000 0.000000 0.500000 Ba\n0.000000 0.000000 0.000000 Nd\n0.500000 0.500000 0.750482 Co\n0.500000 0.500000 0.249518 Co\n0.500000 0.500000 -0.000000 O\n0.500000 0.500000 0.500000 O\n-0.000000 0.500000 0.774260 O\n0.500000 0.000000 0.774260 O\n-0.000000 0.500000 0.225740 O\n0.500000 0.000000 0.225740 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"Nd",
"Co",
"O"
],
"chemical_system": "Ba-Co-Nd-O",
"density": 7.144109936923453,
"density_atomic": 0.08683906953152022,
"volume": 115.15554063335826,
"volume_molar": 6.93482874987983,
"formula_full": "Ba1 Nd1 Co2 O6",
"formula_reduced": "BaNd(CoO3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.469656027,
"spacegroup": 123
},
{
"id": "jvasp-21594",
"created_at": "2022-09-04T14:37:59.680228Z",
"updated_at": "2022-09-04T14:37:59.680257Z",
"structure_string": "Ba2 Nd2 Cu2 B2 O10\n1.0\n5.547599 -0.000000 0.000000\n-0.000000 5.547599 -0.000000\n-0.000000 -0.000000 7.577454\nBa Nd Cu B O\n2 2 2 2 10\ndirect\n0.500000 0.500000 0.510070 Ba\n0.000000 0.000000 0.510070 Ba\n0.500000 0.500000 0.003490 Nd\n0.000000 0.000000 0.003490 Nd\n0.000000 0.500000 0.780683 Cu\n0.500000 0.000000 0.780683 Cu\n0.500000 0.000000 0.266151 B\n0.000000 0.500000 0.266151 B\n0.247650 0.252350 0.797348 O\n0.252350 0.752350 0.797348 O\n0.655437 0.844563 0.178273 O\n0.844563 0.344563 0.178273 O\n0.344563 0.155437 0.178273 O\n0.000000 0.500000 0.449761 O\n0.155437 0.655437 0.178273 O\n0.752350 0.747650 0.797348 O\n0.500000 0.000000 0.449761 O\n0.747650 0.247650 0.797348 O\n",
"nsites": 18,
"nelements": 5,
"elements": [
"Ba",
"Nd",
"Cu",
"B",
"O"
],
"chemical_system": "B-Ba-Cu-Nd-O",
"density": 6.208053426795045,
"density_atomic": 0.07718609579033879,
"volume": 233.202623033215,
"volume_molar": 7.802105675040216,
"formula_full": "Ba2 Nd2 Cu2 B2 O10",
"formula_reduced": "BaNdCuBO5",
"formula_anonymous": "ABCDE5",
"energy_above_hull": 2.0025120003703694,
"spacegroup": 100
},
{
"id": "jvasp-112605",
"created_at": "2022-09-04T14:38:42.098120Z",
"updated_at": "2022-09-04T14:38:42.098130Z",
"structure_string": "Ba2 Nd2 Cu2 Te6\n1.0\n7.797322 0.016029 0.000000\n-6.509598 4.292275 0.000000\n-0.000000 -0.000000 11.669624\nBa Nd Cu Te\n2 2 2 6\ndirect\n0.250987 0.749015 0.250000 Ba\n0.749014 0.250987 0.750000 Ba\n0.000000 0.000000 0.000000 Nd\n0.000000 0.000000 0.500000 Nd\n0.533351 0.466650 0.250000 Cu\n0.466650 0.533351 0.750000 Cu\n0.640943 0.359058 0.065599 Te\n0.359057 0.640944 0.934401 Te\n0.359057 0.640944 0.565598 Te\n0.640943 0.359058 0.434401 Te\n0.928126 0.071874 0.250000 Te\n0.071875 0.928127 0.750000 Te\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Ba",
"Nd",
"Cu",
"Te"
],
"chemical_system": "Ba-Cu-Nd-Te",
"density": 6.170466773505509,
"density_atomic": 0.030629471417235293,
"volume": 391.7795327426893,
"volume_molar": 19.661262442195866,
"formula_full": "Ba2 Nd2 Cu2 Te6",
"formula_reduced": "BaNdCuTe3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 0.46507187,
"spacegroup": 63
},
{
"id": "jvasp-85595",
"created_at": "2022-09-04T14:35:56.245484Z",
"updated_at": "2022-09-04T14:35:56.245507Z",
"structure_string": "Ba2 Nd2 Fe4 O10\n1.0\n3.948146 0.000000 0.000000\n0.000000 7.553679 0.000000\n0.000000 0.000000 7.896314\nBa Nd Fe O\n2 2 4 10\ndirect\n0.000000 0.999999 0.003429 Ba\n0.000000 0.000001 0.503428 Ba\n0.000000 0.500001 0.003419 Nd\n0.000000 0.499999 0.503418 Nd\n0.500000 0.266269 0.253422 Fe\n0.500000 0.266265 0.753418 Fe\n0.500000 0.733735 0.253418 Fe\n0.500000 0.733731 0.753421 Fe\n0.500000 0.702323 0.503417 O\n0.500000 0.702314 0.003426 O\n0.000000 0.297679 0.253420 O\n0.500000 0.000003 0.253429 O\n0.000000 0.702321 0.753420 O\n0.000000 0.702331 0.253420 O\n0.500000 0.297677 0.003417 O\n0.500000 -0.000003 0.753428 O\n0.000000 0.297669 0.753420 O\n0.500000 0.297686 0.503426 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Ba",
"Nd",
"Fe",
"O"
],
"chemical_system": "Ba-Fe-Nd-O",
"density": 6.674197939114442,
"density_atomic": 0.07643572087201222,
"volume": 235.4919898006862,
"volume_molar": 7.878699502401205,
"formula_full": "Ba2 Nd2 Fe4 O10",
"formula_reduced": "BaNdFe2O5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 2.406302885555556,
"spacegroup": 123
},
{
"id": "jvasp-109785",
"created_at": "2022-09-04T14:38:19.969854Z",
"updated_at": "2022-09-04T14:38:19.969874Z",
"structure_string": "Ba1 Nd1 Fe1 Co1 O6\n1.0\n3.882192 -0.000000 0.000000\n0.000000 3.882192 0.000000\n-0.000000 -0.000000 7.702214\nBa Nd Fe Co O\n1 1 1 1 6\ndirect\n0.000000 0.000000 0.997026 Ba\n0.000000 0.000000 0.504789 Nd\n0.500000 0.500000 0.253584 Fe\n0.500000 0.500000 0.749422 Co\n0.500000 0.500000 0.006264 O\n-0.000000 0.500000 0.724625 O\n0.500000 0.000000 0.724625 O\n-0.000000 0.500000 0.270974 O\n0.500000 0.000000 0.270974 O\n0.500000 0.500000 0.497713 O\n",
"nsites": 10,
"nelements": 5,
"elements": [
"Ba",
"Nd",
"Fe",
"Co",
"O"
],
"chemical_system": "Ba-Co-Fe-Nd-O",
"density": 7.042839451340577,
"density_atomic": 0.08614506408011897,
"volume": 116.08326149365364,
"volume_molar": 6.9906974059467,
"formula_full": "Ba1 Nd1 Fe1 Co1 O6",
"formula_reduced": "BaNdFeCoO6",
"formula_anonymous": "ABCDE6",
"energy_above_hull": 2.473999487,
"spacegroup": 99
},
{
"id": "jvasp-104760",
"created_at": "2022-09-04T14:36:57.911785Z",
"updated_at": "2022-09-04T14:36:57.911821Z",
"structure_string": "Ba1 Nd1 Fe2 O6\n1.0\n4.754215 -0.000000 2.744847\n1.584738 4.482316 2.744847\n-0.000000 -0.000000 5.489694\nBa Nd Fe O\n1 1 2 6\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.500000 Nd\n0.749999 0.750001 0.750000 Fe\n0.250000 0.250000 0.250000 Fe\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.000001 O\n0.500000 0.500000 0.000001 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"Nd",
"Fe",
"O"
],
"chemical_system": "Ba-Fe-Nd-O",
"density": 6.94472893842625,
"density_atomic": 0.08548119289373422,
"volume": 116.98479702349826,
"volume_molar": 7.044989144555355,
"formula_full": "Ba1 Nd1 Fe2 O6",
"formula_reduced": "BaNd(FeO3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.486093947,
"spacegroup": 225
},
{
"id": "jvasp-57204",
"created_at": "2022-09-04T14:38:27.557508Z",
"updated_at": "2022-09-04T14:38:27.557532Z",
"structure_string": "Ba1 Nd1 Mn2 O5\n1.0\n3.970078 0.000000 -0.000000\n0.000000 3.970078 0.000000\n0.000000 0.000000 7.672671\nBa Nd Mn O\n1 1 2 5\ndirect\n0.000000 0.000000 0.500000 Ba\n0.000000 0.000000 0.000000 Nd\n0.500000 0.500000 0.764301 Mn\n0.500000 0.500000 0.235699 Mn\n0.000000 0.500000 0.199373 O\n0.500000 0.000000 0.800627 O\n0.500000 0.000000 0.199373 O\n0.000000 0.500000 0.800627 O\n0.500000 0.500000 0.500000 O\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Ba",
"Nd",
"Mn",
"O"
],
"chemical_system": "Ba-Mn-Nd-O",
"density": 6.4734052507994875,
"density_atomic": 0.07442140320411064,
"volume": 120.93295224918425,
"volume_molar": 8.09194734407718,
"formula_full": "Ba1 Nd1 Mn2 O5",
"formula_reduced": "BaNdMn2O5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 2.59593771697318,
"spacegroup": 123
},
{
"id": "jvasp-100459",
"created_at": "2022-09-04T14:37:09.276553Z",
"updated_at": "2022-09-04T14:37:09.276858Z",
"structure_string": "Ba1 Nd1 Mn2 O6\n1.0\n3.905367 0.000000 -0.000000\n0.000000 3.905367 -0.000000\n0.000000 -0.000000 7.802637\nBa Nd Mn O\n1 1 2 6\ndirect\n0.000000 0.000000 0.499999 Ba\n0.000000 0.000000 0.000000 Nd\n0.500001 0.500001 0.753789 Mn\n0.500001 0.500001 0.246211 Mn\n0.500001 0.500001 0.000000 O\n0.000000 0.500001 0.773372 O\n0.500001 0.000000 0.773372 O\n0.000000 0.500001 0.226628 O\n0.500001 0.500001 0.499999 O\n0.500001 0.000000 0.226628 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"Nd",
"Mn",
"O"
],
"chemical_system": "Ba-Mn-Nd-O",
"density": 6.801527884950886,
"density_atomic": 0.084030102403458,
"volume": 119.00497219420836,
"volume_molar": 7.166646936934089,
"formula_full": "Ba1 Nd1 Mn2 O6",
"formula_reduced": "BaNdMn2O6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.650383295275862,
"spacegroup": 123
}
]
}