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=-updated_at&page=1593",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-updated_at&page=1591",
"results": [
{
"id": "jvasp-41278",
"created_at": "2022-09-04T14:37:52.381375Z",
"updated_at": "2022-09-04T14:37:52.381404Z",
"structure_string": "Ti1 Zn1 Ir2\n1.0\n0.000001 3.066552 3.066552\n3.066553 0.000001 3.066552\n3.066554 3.066553 -0.000000\nTi Zn Ir\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Ti\n0.750000 0.749999 0.749999 Zn\n0.000000 0.000000 0.000000 Ir\n0.499999 0.499998 0.499998 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ti",
"Zn",
"Ir"
],
"chemical_system": "Ir-Ti-Zn",
"density": 14.329938495861533,
"density_atomic": 0.06935517207533962,
"volume": 57.67414138421937,
"volume_molar": 8.683044940697757,
"formula_full": "Ti1 Zn1 Ir2",
"formula_reduced": "TiZnIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.689275233333333,
"spacegroup": 225
},
{
"id": "jvasp-78382",
"created_at": "2022-09-04T14:37:52.380402Z",
"updated_at": "2022-09-04T14:37:52.380426Z",
"structure_string": "K1 P1\n1.0\n0.000000 -4.676843 0.000000\n3.504766 -2.338421 -2.046650\n3.091621 -2.338421 2.622611\nK P\n1 1\ndirect\n0.000000 0.000000 0.000000 K\n0.499999 0.500000 0.500000 P\n",
"nsites": 2,
"nelements": 2,
"elements": [
"K",
"P"
],
"chemical_system": "K-P",
"density": 1.6031514824395143,
"density_atomic": 0.027555643760532635,
"volume": 72.58041283232721,
"volume_molar": 21.85447312475924,
"formula_full": "K1 P1",
"formula_reduced": "KP",
"formula_anonymous": "AB",
"energy_above_hull": 0.9285335,
"spacegroup": 225
},
{
"id": "jvasp-97581",
"created_at": "2022-09-04T14:37:52.374129Z",
"updated_at": "2022-09-04T14:37:52.374143Z",
"structure_string": "La4 Ni2 O8\n1.0\n4.891889 -0.000000 -2.132820\n0.000000 5.391768 -0.000000\n0.156289 -0.000000 7.034957\nLa Ni O\n4 2 8\ndirect\n0.862531 0.493609 0.725062 La\n0.137469 0.506390 0.274939 La\n0.362532 0.006390 0.725062 La\n0.637469 0.993611 0.274939 La\n0.500001 0.500000 0.000000 Ni\n0.000000 0.000000 0.000000 Ni\n0.318073 0.470725 0.636148 O\n0.681928 0.529276 0.363853 O\n0.181927 0.970725 0.363853 O\n0.818074 0.029276 0.636148 O\n0.256485 0.250000 0.012969 O\n0.243515 0.749999 0.987031 O\n0.756484 0.250000 0.012969 O\n0.743516 0.749999 0.987032 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"La",
"Ni",
"O"
],
"chemical_system": "La-Ni-O",
"density": 7.099506211833224,
"density_atomic": 0.07472612498269121,
"volume": 187.35080941562023,
"volume_molar": 8.058949612862845,
"formula_full": "La4 Ni2 O8",
"formula_reduced": "La2NiO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.9438952,
"spacegroup": 64
},
{
"id": "jvasp-25323",
"created_at": "2022-09-04T14:37:52.373652Z",
"updated_at": "2022-09-04T14:37:52.373681Z",
"structure_string": "Tb1\n1.0\n3.047049 0.000000 1.759215\n1.015683 2.872785 1.759215\n0.000000 -0.000000 3.518429\nTb\n1\ndirect\n0.000000 0.000000 0.000000 Tb\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Tb"
],
"chemical_system": "Tb",
"density": 8.568620719048694,
"density_atomic": 0.03246898000035613,
"volume": 30.798626873681634,
"volume_molar": 18.547366624802955,
"formula_full": "Tb1",
"formula_reduced": "Tb",
"formula_anonymous": "A",
"energy_above_hull": 0.01113,
"spacegroup": 225
},
{
"id": "jvasp-41330",
"created_at": "2022-09-04T14:37:52.367113Z",
"updated_at": "2022-09-04T14:37:52.367135Z",
"structure_string": "Hf2 Os1 Rh1\n1.0\n0.000000 3.258408 3.258408\n3.258408 -0.000000 3.258408\n3.258408 3.258408 0.000000\nHf Os Rh\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Hf\n0.500001 0.500001 0.500001 Hf\n0.250001 0.250001 0.250001 Os\n0.750000 0.750000 0.750000 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Os",
"Rh"
],
"chemical_system": "Hf-Os-Rh",
"density": 15.602465549225812,
"density_atomic": 0.05781141583177709,
"volume": 69.19048673084612,
"volume_molar": 10.416871258651687,
"formula_full": "Hf2 Os1 Rh1",
"formula_reduced": "Hf2OsRh",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.742451,
"spacegroup": 225
},
{
"id": "jvasp-25280",
"created_at": "2022-09-04T14:37:52.366030Z",
"updated_at": "2022-09-04T14:37:52.366056Z",
"structure_string": "C16\n1.0\n2.522127 0.000000 0.000000\n-1.261064 2.184226 -0.000000\n0.000000 -0.000000 16.559070\nC\n16\ndirect\n0.000000 0.000000 0.953300 C\n0.666669 0.333334 0.297422 C\n0.333335 0.666668 0.797422 C\n0.666669 0.333334 0.202578 C\n0.333335 0.666668 0.077867 C\n0.333335 0.666668 0.328793 C\n0.333335 0.666668 0.422133 C\n0.666669 0.333334 0.671207 C\n0.333335 0.666668 0.702578 C\n0.000000 0.000000 0.453300 C\n0.000000 0.000000 0.046700 C\n0.333335 0.666668 0.171207 C\n0.666669 0.333334 0.828793 C\n0.000000 0.000000 0.546700 C\n0.666669 0.333334 0.577867 C\n0.666669 0.333334 0.922133 C\n",
"nsites": 16,
"nelements": 1,
"elements": [
"C"
],
"chemical_system": "C",
"density": 3.4981379634576677,
"density_atomic": 0.17539593213652718,
"volume": 91.2221840330122,
"volume_molar": 3.4334552042588995,
"formula_full": "C16",
"formula_reduced": "C",
"formula_anonymous": "A",
"energy_above_hull": 0.1073699999999995,
"spacegroup": 194
},
{
"id": "jvasp-91893",
"created_at": "2022-09-04T14:37:52.360875Z",
"updated_at": "2022-09-04T14:37:52.360886Z",
"structure_string": "Na1 Mg7\n1.0\n6.506155 0.000000 -0.000000\n-3.253078 5.634495 0.000000\n0.000000 0.000000 5.223055\nNa Mg\n1 7\ndirect\n0.166667 0.333333 0.250000 Na\n0.168765 0.834382 0.250000 Mg\n0.665618 0.331235 0.250000 Mg\n0.665617 0.834382 0.250000 Mg\n0.335585 0.164415 0.750001 Mg\n0.335585 0.671171 0.750001 Mg\n0.828829 0.164415 0.750001 Mg\n0.833333 0.666666 0.750001 Mg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Na",
"Mg"
],
"chemical_system": "Mg-Na",
"density": 1.6748775947706316,
"density_atomic": 0.04178168827361971,
"volume": 191.4714395361346,
"volume_molar": 14.413349505080395,
"formula_full": "Na1 Mg7",
"formula_reduced": "NaMg7",
"formula_anonymous": "AB7",
"energy_above_hull": 0.0,
"spacegroup": 187
},
{
"id": "jvasp-54664",
"created_at": "2022-09-04T14:37:52.358244Z",
"updated_at": "2022-09-04T14:37:52.358274Z",
"structure_string": "Sc1 Ir3 C1\n1.0\n4.679077 0.000000 0.000000\n0.000000 4.679090 0.000000\n0.000000 0.000000 4.679152\nSc Ir C\n1 3 1\ndirect\n0.500000 0.500000 0.500000 Sc\n0.500000 0.500000 0.000000 Ir\n0.000000 0.500000 0.500000 Ir\n0.500000 0.000000 0.500000 Ir\n0.000000 0.000000 0.000000 C\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sc",
"Ir",
"C"
],
"chemical_system": "C-Ir-Sc",
"density": 10.27040556715859,
"density_atomic": 0.04880690406778862,
"volume": 102.44452287027727,
"volume_molar": 12.338706736316977,
"formula_full": "Sc1 Ir3 C1",
"formula_reduced": "ScIr3C",
"formula_anonymous": "ABC3",
"energy_above_hull": 5.35593371,
"spacegroup": 221
},
{
"id": "jvasp-77339",
"created_at": "2022-09-04T14:37:52.348075Z",
"updated_at": "2022-09-04T14:37:52.348093Z",
"structure_string": "Na1 Mg2 Cd1\n1.0\n-11.097177 -0.000000 -6.406958\n-7.099813 0.252408 -0.516678\n-6.184649 2.840882 -2.101789\nNa Mg Cd\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.725645 -0.000000 0.000000 Mg\n0.274355 -0.000000 0.000000 Mg\n0.500000 -0.000000 0.000000 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Mg",
"Cd"
],
"chemical_system": "Cd-Mg-Na",
"density": 2.807823030375062,
"density_atomic": 0.0367567737260031,
"volume": 108.82347917195607,
"volume_molar": 16.383757739161194,
"formula_full": "Na1 Mg2 Cd1",
"formula_reduced": "NaMg2Cd",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0294821818181817,
"spacegroup": 71
},
{
"id": "jvasp-39110",
"created_at": "2022-09-04T14:37:52.344214Z",
"updated_at": "2022-09-04T14:37:52.344233Z",
"structure_string": "Sc2 Ru1 Au1\n1.0\n0.000008 3.290074 3.290097\n3.290082 0.000007 3.290099\n3.290080 3.290074 0.000009\nSc Ru Au\n2 1 1\ndirect\n-0.000000 0.000001 0.999998 Sc\n0.500000 0.500000 0.499999 Sc\n0.749998 0.750000 0.749999 Ru\n0.250000 0.249999 0.249999 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Ru",
"Au"
],
"chemical_system": "Au-Ru-Sc",
"density": 9.044270699451069,
"density_atomic": 0.05615785215273232,
"volume": 71.22779534233634,
"volume_molar": 10.723595239400545,
"formula_full": "Sc2 Ru1 Au1",
"formula_reduced": "Sc2RuAu",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.3467671425,
"spacegroup": 225
},
{
"id": "jvasp-843",
"created_at": "2022-09-04T14:37:52.334660Z",
"updated_at": "2022-09-04T14:37:52.334681Z",
"structure_string": "C16\n1.0\n4.268256 0.000000 0.000000\n-0.000000 4.931122 0.000000\n0.000000 0.000000 6.747984\nC\n16\ndirect\n0.166694 0.624999 0.750068 C\n0.166693 0.375000 0.249931 C\n0.333307 0.124999 0.249931 C\n0.833307 0.375000 0.249931 C\n0.833307 0.124999 0.750068 C\n0.666694 0.125000 0.249931 C\n0.666694 0.624999 0.249931 C\n0.666694 0.375000 0.750068 C\n0.333307 0.624999 0.249931 C\n0.833307 0.875000 0.249931 C\n0.166694 0.875000 0.249931 C\n0.666694 0.875000 0.750068 C\n0.333307 0.375000 0.750068 C\n0.166693 0.125000 0.750068 C\n0.333307 0.875000 0.750068 C\n0.833307 0.624999 0.750068 C\n",
"nsites": 16,
"nelements": 1,
"elements": [
"C"
],
"chemical_system": "C",
"density": 2.2468141400900814,
"density_atomic": 0.11265480794505504,
"volume": 142.02678333803254,
"volume_molar": 5.345658005947842,
"formula_full": "C16",
"formula_reduced": "C",
"formula_anonymous": "A",
"energy_above_hull": 0.0022199999999994,
"spacegroup": 69
},
{
"id": "jvasp-28685",
"created_at": "2022-09-04T14:37:52.324359Z",
"updated_at": "2022-09-04T14:37:52.324374Z",
"structure_string": "Mo2 W2 S8\n1.0\n3.192119 -0.000000 0.000000\n-1.596059 2.764439 0.000429\n0.000000 0.005459 32.263491\nMo W S\n2 2 8\ndirect\n0.333933 0.667866 0.085104 Mo\n0.333102 0.666204 0.472536 Mo\n0.666836 0.333672 0.278808 W\n0.666130 0.332261 0.666466 W\n0.333426 0.666855 0.327640 S\n0.332672 0.665346 0.715267 S\n0.667369 0.334735 0.036594 S\n0.666532 0.333062 0.423988 S\n0.667176 0.334352 0.133657 S\n0.666338 0.332678 0.521085 S\n0.333571 0.667143 0.229978 S\n0.332914 0.665829 0.617627 S\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Mo",
"W",
"S"
],
"chemical_system": "Mo-S-W",
"density": 4.759752838337825,
"density_atomic": 0.042148664226819246,
"volume": 284.7065315148086,
"volume_molar": 14.28785673394628,
"formula_full": "Mo2 W2 S8",
"formula_reduced": "MoWS4",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.8312943166666655,
"spacegroup": 156
}
]
}