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=3668",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=3666",
"results": [
{
"id": "jvasp-16068",
"created_at": "2022-09-04T14:36:40.602284Z",
"updated_at": "2022-09-04T14:36:40.602303Z",
"structure_string": "Ca1 P2 Rh2\n1.0\n3.776311 0.000000 -1.450274\n-0.556971 3.735011 -1.450274\n0.005393 0.006257 5.655672\nCa P Rh\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.615822 0.615822 0.231644 P\n0.384178 0.384179 0.768357 P\n0.250000 0.750000 0.500001 Rh\n0.750000 0.250000 0.500001 Rh\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ca",
"P",
"Rh"
],
"chemical_system": "Ca-P-Rh",
"density": 6.402541902557409,
"density_atomic": 0.06262578603623298,
"volume": 79.8393172599412,
"volume_molar": 9.616072134433269,
"formula_full": "Ca1 P2 Rh2",
"formula_reduced": "Ca(PRh)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.215551484,
"spacegroup": 139
},
{
"id": "jvasp-16132",
"created_at": "2022-09-04T14:36:47.628636Z",
"updated_at": "2022-09-04T14:36:47.628666Z",
"structure_string": "Ba1 Cu2 As2\n1.0\n3.971506 -0.000000 -1.604073\n-0.647877 3.918306 -1.604073\n0.305957 0.360701 6.476061\nBa Cu As\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.750001 0.250000 0.500001 Cu\n0.250000 0.750001 0.500001 Cu\n0.638205 0.638206 0.276411 As\n0.361796 0.361795 0.723590 As\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ba",
"Cu",
"As"
],
"chemical_system": "As-Ba-Cu",
"density": 6.528195551702931,
"density_atomic": 0.047450277305951256,
"volume": 105.37346215620315,
"volume_molar": 12.691476429463767,
"formula_full": "Ba1 Cu2 As2",
"formula_reduced": "Ba(CuAs)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.646706074,
"spacegroup": 139
},
{
"id": "jvasp-106810",
"created_at": "2022-09-04T14:37:00.285407Z",
"updated_at": "2022-09-04T14:37:00.285436Z",
"structure_string": "Er1 Si2 Pt2\n1.0\n3.913070 -0.026915 -4.316211\n-0.602232 3.866543 -4.316211\n0.023208 0.026915 5.825913\nEr Si Pt\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Er\n0.750000 0.249999 0.500000 Si\n0.250001 0.750000 0.500000 Si\n0.633475 0.633473 -0.000001 Pt\n0.366525 0.366525 -0.000000 Pt\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Er",
"Si",
"Pt"
],
"chemical_system": "Er-Pt-Si",
"density": 11.45266437596731,
"density_atomic": 0.056200930391679164,
"volume": 88.96649868878818,
"volume_molar": 10.715375560564757,
"formula_full": "Er1 Si2 Pt2",
"formula_reduced": "Er(SiPt)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.559786,
"spacegroup": 139
},
{
"id": "jvasp-15713",
"created_at": "2022-09-04T14:36:40.305842Z",
"updated_at": "2022-09-04T14:36:40.305866Z",
"structure_string": "Sc1 Si2 Cu2\n1.0\n3.616741 -0.000000 -1.277526\n-0.451255 3.588479 -1.277526\n-0.003275 -0.003712 5.749081\nSc Si Cu\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sc\n0.612864 0.612866 0.225731 Si\n0.387133 0.387135 0.774267 Si\n0.749999 0.250000 0.499999 Cu\n0.249998 0.750000 0.499999 Cu\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sc",
"Si",
"Cu"
],
"chemical_system": "Cu-Sc-Si",
"density": 5.081292543066622,
"density_atomic": 0.0670414618129026,
"volume": 74.58071266336431,
"volume_molar": 8.982710992797887,
"formula_full": "Sc1 Si2 Cu2",
"formula_reduced": "Sc(CuSi)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.6185246699999998,
"spacegroup": 139
},
{
"id": "jvasp-8291",
"created_at": "2022-09-04T14:36:43.637572Z",
"updated_at": "2022-09-04T14:36:43.637592Z",
"structure_string": "Zn1 Co2 N2\n1.0\n3.456287 0.000000 0.000000\n0.000000 3.456287 0.000000\n0.000000 0.000000 4.963400\nZn Co N\n1 2 2\ndirect\n0.000000 0.000000 0.500000 Zn\n0.500000 0.500000 0.244257 Co\n0.500000 0.500000 0.755743 Co\n0.000000 0.500000 0.765541 N\n0.500000 0.000000 0.234460 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Zn",
"Co",
"N"
],
"chemical_system": "Co-N-Zn",
"density": 5.917342147602498,
"density_atomic": 0.08432787028184896,
"volume": 59.29237846619991,
"volume_molar": 7.141340982372975,
"formula_full": "Zn1 Co2 N2",
"formula_reduced": "Zn(CoN)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.33712174,
"spacegroup": 115
},
{
"id": "jvasp-5008",
"created_at": "2022-09-04T14:37:05.968300Z",
"updated_at": "2022-09-04T14:37:05.968309Z",
"structure_string": "Ce2 Sb1 O2\n1.0\n3.834542 -0.000000 -1.077890\n-0.302995 3.822552 -1.077890\n-0.114547 -0.123986 6.952045\nCe Sb O\n2 1 2\ndirect\n0.653907 0.653908 0.307816 Ce\n0.346090 0.346091 0.692183 Ce\n0.000000 0.000000 0.000000 Sb\n0.249998 0.749999 0.499999 O\n0.749999 0.249999 0.499999 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ce",
"Sb",
"O"
],
"chemical_system": "Ce-O-Sb",
"density": 7.143982581130547,
"density_atomic": 0.04956564598307588,
"volume": 100.87632070219044,
"volume_molar": 12.149828052389855,
"formula_full": "Ce2 Sb1 O2",
"formula_reduced": "Ce2SbO2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.7327868199999996,
"spacegroup": 139
},
{
"id": "jvasp-101244",
"created_at": "2022-09-04T14:36:40.290856Z",
"updated_at": "2022-09-04T14:36:40.290883Z",
"structure_string": "Sr2 Ca1 N2\n1.0\n3.757541 0.000410 0.000236\n-1.878316 3.254763 -0.000411\n0.000461 -0.000900 9.462532\nSr Ca N\n2 1 2\ndirect\n0.666675 0.333272 0.215091 Sr\n0.333323 0.666727 0.784910 Sr\n-0.000000 -0.000000 0.500000 Ca\n0.666713 0.333230 0.661385 N\n0.333285 0.666769 0.338616 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"Ca",
"N"
],
"chemical_system": "Ca-N-Sr",
"density": 3.491318352989188,
"density_atomic": 0.04320283072167858,
"volume": 115.73315721395703,
"volume_molar": 13.939227266833173,
"formula_full": "Sr2 Ca1 N2",
"formula_reduced": "Sr2CaN2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.7140979079999998,
"spacegroup": 164
},
{
"id": "jvasp-2685",
"created_at": "2022-09-04T14:37:00.378639Z",
"updated_at": "2022-09-04T14:37:00.378668Z",
"structure_string": "Rb2 Pt1 S2\n1.0\n3.526533 0.000000 1.044122\n1.256718 5.850218 2.232931\n0.026900 0.017143 6.386654\nRb Pt S\n2 1 2\ndirect\n0.807678 0.692321 0.692321 Rb\n0.192321 0.307679 0.307678 Rb\n0.000000 0.000000 0.000000 Pt\n0.500000 0.788255 0.211745 S\n0.500000 0.211745 0.788254 S\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Rb",
"Pt",
"S"
],
"chemical_system": "Pt-Rb-S",
"density": 5.43236036521805,
"density_atomic": 0.038026815309945096,
"volume": 131.48616204766319,
"volume_molar": 15.836563516863949,
"formula_full": "Rb2 Pt1 S2",
"formula_reduced": "Rb2PtS2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.7582482799999998,
"spacegroup": 71
},
{
"id": "jvasp-11153",
"created_at": "2022-09-04T14:36:40.268557Z",
"updated_at": "2022-09-04T14:36:40.268582Z",
"structure_string": "Sr2 Cu4 O4\n1.0\n4.936308 0.000000 -2.404545\n-1.171287 4.795333 -2.404545\n0.009394 0.011965 6.288450\nSr Cu O\n2 4 4\ndirect\n0.625000 0.375000 0.250001 Sr\n0.374999 0.625000 0.750001 Sr\n0.500000 0.000000 0.500001 Cu\n0.000000 0.000000 0.000000 Cu\n-0.000000 0.000000 0.500000 Cu\n-0.000000 0.500000 0.000000 Cu\n0.126176 0.376176 0.252354 O\n0.376176 0.126177 0.752354 O\n0.873823 0.623824 0.747647 O\n0.623823 0.873823 0.247647 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Sr",
"Cu",
"O"
],
"chemical_system": "Cu-O-Sr",
"density": 5.49382370547245,
"density_atomic": 0.0670513404285771,
"volume": 149.13944950365266,
"volume_molar": 8.981387577799085,
"formula_full": "Sr2 Cu4 O4",
"formula_reduced": "Sr(CuO)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.4129948419999995,
"spacegroup": 141
},
{
"id": "jvasp-50724",
"created_at": "2022-09-04T14:37:00.451100Z",
"updated_at": "2022-09-04T14:37:00.451126Z",
"structure_string": "Li1 Fe2 P2\n1.0\n-0.000000 3.755921 -0.000000\n1.877962 -1.877962 4.548849\n3.755921 -0.000000 0.000000\nLi Fe P\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.250000 0.500000 0.250000 Fe\n0.750000 0.500000 0.749999 Fe\n0.626638 0.253276 0.373361 P\n0.373362 0.746724 0.626638 P\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Li",
"Fe",
"P"
],
"chemical_system": "Fe-Li-P",
"density": 4.672838568781616,
"density_atomic": 0.07791760336817402,
"volume": 64.170351549112,
"volume_molar": 7.728857792948729,
"formula_full": "Li1 Fe2 P2",
"formula_reduced": "Li(FeP)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.7523664,
"spacegroup": 139
},
{
"id": "jvasp-3249",
"created_at": "2022-09-04T14:36:52.076844Z",
"updated_at": "2022-09-04T14:36:52.076857Z",
"structure_string": "Nd2 Se1 O2\n1.0\n2.004063 -3.471140 0.000000\n2.004063 3.471140 0.000000\n0.000000 0.000000 7.055047\nNd Se O\n2 1 2\ndirect\n0.666666 0.333332 0.712141 Nd\n0.333332 0.666666 0.287860 Nd\n0.000000 0.000000 0.000000 Se\n0.666666 0.333332 0.373975 O\n0.333332 0.666666 0.626026 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Nd",
"Se",
"O"
],
"chemical_system": "Nd-O-Se",
"density": 6.757565868906119,
"density_atomic": 0.05093972512658594,
"volume": 98.15522144210493,
"volume_molar": 11.822091197066523,
"formula_full": "Nd2 Se1 O2",
"formula_reduced": "Nd2SeO2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.3816726733333329,
"spacegroup": 164
},
{
"id": "jvasp-15519",
"created_at": "2022-09-04T14:36:52.184243Z",
"updated_at": "2022-09-04T14:36:52.184272Z",
"structure_string": "Pr1 Co2 Si2\n1.0\n3.728748 -0.000000 -1.381336\n-0.511724 3.693468 -1.381336\n0.013813 0.015859 5.760606\nPr Co Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Pr\n0.250001 0.750000 0.500000 Co\n0.750000 0.250000 0.500000 Co\n0.635657 0.635657 0.271313 Si\n0.364343 0.364344 0.728687 Si\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Pr",
"Co",
"Si"
],
"chemical_system": "Co-Pr-Si",
"density": 6.5784706720469,
"density_atomic": 0.06289426940378047,
"volume": 79.49849878849945,
"volume_molar": 9.575022998260662,
"formula_full": "Pr1 Co2 Si2",
"formula_reduced": "Pr(CoSi)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.95208977,
"spacegroup": 139
}
]
}