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=spacegroup&page=884",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=spacegroup&page=882",
"results": [
{
"id": "jvasp-79149",
"created_at": "2022-09-04T14:38:03.344027Z",
"updated_at": "2022-09-04T14:38:03.344057Z",
"structure_string": "Ag2 N2\n1.0\n3.955770 -1.121543 -0.074633\n-1.244591 3.919507 0.032766\n0.077931 -0.008437 4.099091\nAg N\n2 2\ndirect\n0.400072 0.720810 -0.003478 Ag\n0.712295 0.408655 0.496486 Ag\n0.559627 0.828986 0.496441 N\n0.820385 0.568111 -0.003595 N\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ag",
"N"
],
"chemical_system": "Ag-N",
"density": 6.996221693008592,
"density_atomic": 0.06914012949019568,
"volume": 57.85352196320682,
"volume_molar": 8.710051318104576,
"formula_full": "Ag2 N2",
"formula_reduced": "AgN",
"formula_anonymous": "AB",
"energy_above_hull": 2.387550255,
"spacegroup": 40
},
{
"id": "jvasp-46958",
"created_at": "2022-09-04T14:38:03.909779Z",
"updated_at": "2022-09-04T14:38:03.909802Z",
"structure_string": "V8 O8 F8\n1.0\n4.658988 -0.006193 -0.000000\n-0.006193 4.658988 -0.000000\n0.000000 0.000000 12.256489\nV O F\n8 8 8\ndirect\n0.968204 0.968204 0.000000 V\n0.015461 0.048779 0.250000 V\n0.968204 0.968204 0.500000 V\n0.048779 0.015461 0.750000 V\n0.528126 0.472666 0.124939 V\n0.472666 0.528126 0.624939 V\n0.472666 0.528126 0.875061 V\n0.528126 0.472666 0.375061 V\n0.814983 0.187322 0.374108 O\n0.814983 0.187322 0.125892 O\n0.685502 0.685502 0.500000 O\n0.685502 0.685502 0.000000 O\n0.306011 0.317467 0.750000 O\n0.317467 0.306011 0.250000 O\n0.187322 0.814983 0.625892 O\n0.187322 0.814983 0.874108 O\n0.204758 0.792411 0.124856 F\n0.204758 0.792411 0.375145 F\n0.291922 0.291922 0.000000 F\n0.291922 0.291922 0.500000 F\n0.724548 0.695962 0.250000 F\n0.695962 0.724548 0.750000 F\n0.792411 0.204758 0.624856 F\n0.792411 0.204758 0.875145 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"V",
"O",
"F"
],
"chemical_system": "F-O-V",
"density": 4.291236166532611,
"density_atomic": 0.09021167478418458,
"volume": 266.04095376142544,
"volume_molar": 6.6755669644831475,
"formula_full": "V8 O8 F8",
"formula_reduced": "VOF",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0586226608333331,
"spacegroup": 40
},
{
"id": "jvasp-108048",
"created_at": "2022-09-04T14:38:06.331041Z",
"updated_at": "2022-09-04T14:38:06.331067Z",
"structure_string": "Yb2 B2 O6\n1.0\n3.874985 0.270177 0.000000\n-1.535203 3.568145 0.000000\n0.000000 0.000000 8.510992\nYb B O\n2 2 6\ndirect\n0.915885 0.915885 0.500000 Yb\n0.915885 0.915885 -0.000000 Yb\n0.511092 0.227556 0.250000 B\n0.227555 0.511092 0.750000 B\n0.675219 0.340176 0.392289 O\n0.340176 0.675219 0.607711 O\n0.340176 0.675219 0.892289 O\n0.675219 0.340176 0.107711 O\n0.170550 -0.025031 0.250000 O\n-0.025032 0.170550 0.750000 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Yb",
"B",
"O"
],
"chemical_system": "B-O-Yb",
"density": 6.352655990663404,
"density_atomic": 0.08250317143395994,
"volume": 121.20746180047816,
"volume_molar": 7.299283961248025,
"formula_full": "Yb2 B2 O6",
"formula_reduced": "YbBO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.7865167566666666,
"spacegroup": 40
},
{
"id": "jvasp-30257",
"created_at": "2022-09-04T14:38:07.022414Z",
"updated_at": "2022-09-04T14:38:07.022439Z",
"structure_string": "V4 O4 F12\n1.0\n5.625160 0.000000 0.000000\n0.000000 5.622195 0.000000\n0.000000 0.000000 8.045094\nV O F\n4 4 12\ndirect\n0.483553 0.330404 0.250017 V\n0.483553 0.669597 0.750017 V\n0.983553 0.830405 0.249982 V\n0.983553 0.169596 0.749982 V\n0.270020 0.480571 0.750025 O\n0.270020 0.519430 0.250025 O\n0.770020 0.019429 0.249975 O\n0.770020 0.980571 0.749974 O\n0.743475 0.475742 0.750117 F\n0.743475 0.524259 0.250117 F\n0.499869 0.756132 0.960478 F\n0.499869 0.243869 0.460478 F\n0.500045 0.755868 0.539511 F\n0.999869 0.256132 0.539521 F\n0.243475 0.975742 0.749882 F\n0.243475 0.024259 0.249882 F\n0.000045 0.255867 0.960488 F\n0.999869 0.743869 0.039521 F\n0.500045 0.244133 0.039511 F\n0.000045 0.744134 0.460488 F\n",
"nsites": 20,
"nelements": 3,
"elements": [
"V",
"O",
"F"
],
"chemical_system": "F-O-V",
"density": 3.2354525938052645,
"density_atomic": 0.07860643282987069,
"volume": 254.43210281894306,
"volume_molar": 7.661129685192339,
"formula_full": "V4 O4 F12",
"formula_reduced": "VOF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.8074357094999999,
"spacegroup": 40
},
{
"id": "jvasp-46787",
"created_at": "2022-09-04T14:38:07.518738Z",
"updated_at": "2022-09-04T14:38:07.518773Z",
"structure_string": "Li4 Si4 Ni4 O14\n1.0\n5.015066 0.000000 0.000000\n-2.507533 4.112912 0.000000\n0.000000 0.000000 13.057951\nLi Si Ni O\n4 4 4 14\ndirect\n0.341689 0.594450 0.583241 Li\n0.341689 0.594450 0.916759 Li\n0.747239 0.405549 0.416759 Li\n0.747239 0.405549 0.083241 Li\n0.398683 0.702607 0.363633 Si\n0.398683 0.702607 0.136367 Si\n0.696076 0.297393 0.636367 Si\n0.696076 0.297393 0.863632 Si\n0.014176 0.996356 0.750000 Ni\n0.017819 0.003643 0.250000 Ni\n0.040040 0.000000 0.000000 Ni\n0.040040 0.000000 0.500000 Ni\n0.327909 0.193188 0.864917 O\n0.752618 0.027729 0.130255 O\n0.752618 0.027729 0.369745 O\n0.848825 0.487234 0.750000 O\n0.327909 0.193188 0.635083 O\n0.367973 0.446906 0.449333 O\n0.134721 0.806812 0.135083 O\n0.724889 0.972271 0.630255 O\n0.724889 0.972271 0.869745 O\n0.361590 0.512765 0.250000 O\n0.134721 0.806812 0.364917 O\n0.921069 0.553094 0.949333 O\n0.367973 0.446906 0.050667 O\n0.921069 0.553094 0.550667 O\n",
"nsites": 26,
"nelements": 4,
"elements": [
"Li",
"Si",
"Ni",
"O"
],
"chemical_system": "Li-Ni-O-Si",
"density": 3.6921677177869157,
"density_atomic": 0.0965322086880852,
"volume": 269.3401544764316,
"volume_molar": 6.238478163758521,
"formula_full": "Li4 Si4 Ni4 O14",
"formula_reduced": "Li2Si2Ni2O7",
"formula_anonymous": "A2B2C2D7",
"energy_above_hull": 2.3571551153846158,
"spacegroup": 40
},
{
"id": "jvasp-36681",
"created_at": "2022-09-04T14:38:07.986503Z",
"updated_at": "2022-09-04T14:38:07.986530Z",
"structure_string": "Y2 W2 N6\n1.0\n3.768059 0.000000 0.000000\n0.000000 5.094814 -1.895029\n0.000000 0.001493 7.800270\nY W N\n2 2 6\ndirect\n0.750000 0.070224 0.661676 Y\n0.250000 0.408548 0.338324 Y\n0.250000 0.700215 0.823256 W\n0.750000 0.876959 0.176743 W\n0.750000 0.165276 0.395858 N\n0.750000 0.826775 0.889281 N\n0.250000 0.937494 0.110719 N\n0.250000 0.347186 0.768968 N\n0.250000 0.769417 0.604141 N\n0.750000 0.578219 0.231032 N\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Y",
"W",
"N"
],
"chemical_system": "N-W-Y",
"density": 6.98039916777064,
"density_atomic": 0.06677492651894006,
"volume": 149.75681024768477,
"volume_molar": 9.018565910801682,
"formula_full": "Y2 W2 N6",
"formula_reduced": "YWN3",
"formula_anonymous": "ABC3",
"energy_above_hull": 5.36526904,
"spacegroup": 40
},
{
"id": "jvasp-12398",
"created_at": "2022-09-04T14:38:09.933428Z",
"updated_at": "2022-09-04T14:38:09.933448Z",
"structure_string": "Al4 Pb2 O8\n1.0\n5.141453 -0.000000 0.000000\n-2.570726 4.637295 -0.000000\n0.000000 -0.000000 8.529847\nAl Pb O\n4 2 8\ndirect\n0.640298 0.344531 0.445820 Al\n0.295768 0.655470 0.554180 Al\n0.640298 0.344531 0.054180 Al\n0.295768 0.655470 0.945820 Al\n0.028029 0.054208 0.250000 Pb\n0.973820 0.945793 0.750000 Pb\n0.538403 0.375574 0.250000 O\n0.162829 0.624427 0.750000 O\n0.354261 0.000000 0.500000 O\n0.354261 0.000000 0.000000 O\n0.000796 0.378463 0.445414 O\n0.622333 0.621538 0.554586 O\n0.622333 0.621538 0.945414 O\n0.000796 0.378463 0.054586 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Al",
"Pb",
"O"
],
"chemical_system": "Al-O-Pb",
"density": 5.309886974239731,
"density_atomic": 0.06883926108617687,
"volume": 203.37231659814026,
"volume_molar": 8.748119408866321,
"formula_full": "Al4 Pb2 O8",
"formula_reduced": "Al2PbO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.7736943457142855,
"spacegroup": 40
},
{
"id": "jvasp-9753",
"created_at": "2022-09-04T14:38:11.376845Z",
"updated_at": "2022-09-04T14:38:11.376874Z",
"structure_string": "K2 Ta2 Cu4 Se8\n1.0\n5.455367 0.000000 -1.639884\n-0.000000 7.719726 -0.000000\n0.000146 -0.000000 9.894552\nK Ta Cu Se\n2 2 4 8\ndirect\n0.442050 0.750000 0.364946 K\n0.077104 0.250000 0.635054 K\n0.610632 0.250000 0.220608 Ta\n0.390024 0.750000 0.779392 Ta\n0.109112 0.250000 0.217863 Cu\n0.891249 0.750000 0.782137 Cu\n0.519235 0.500000 0.000000 Cu\n0.519235 0.000000 0.000000 Cu\n0.254136 0.250000 0.006369 Se\n0.247767 0.750000 0.993631 Se\n0.468258 0.250000 0.428343 Se\n0.039916 0.750000 0.571658 Se\n0.637944 0.008421 0.780645 Se\n0.857301 0.991580 0.219356 Se\n0.637944 0.491580 0.780645 Se\n0.857301 0.508421 0.219356 Se\n",
"nsites": 16,
"nelements": 4,
"elements": [
"K",
"Ta",
"Cu",
"Se"
],
"chemical_system": "Cu-K-Se-Ta",
"density": 5.283897792639892,
"density_atomic": 0.03839689116734088,
"volume": 416.7004023911464,
"volume_molar": 15.683927987175775,
"formula_full": "K2 Ta2 Cu4 Se8",
"formula_reduced": "KTa(CuSe2)2",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.4370464458333332,
"spacegroup": 40
},
{
"id": "jvasp-12314",
"created_at": "2022-09-04T14:38:12.337058Z",
"updated_at": "2022-09-04T14:38:12.337075Z",
"structure_string": "Ga4 Pb2 O8\n1.0\n5.311427 0.000000 0.000000\n-2.655714 4.721810 0.000000\n0.000000 -0.000000 8.632733\nGa Pb O\n4 2 8\ndirect\n0.709945 0.346644 0.447806 Ga\n0.363302 0.653356 0.552194 Ga\n0.709945 0.346644 0.052194 Ga\n0.363302 0.653356 0.947806 Ga\n0.022297 0.048209 0.250000 Pb\n0.974089 0.951791 0.750000 Pb\n0.873677 0.386957 0.250000 O\n0.486720 0.613043 0.750000 O\n0.679818 -0.000000 0.500000 O\n0.679818 -0.000000 0.000000 O\n0.369326 0.361804 0.439609 O\n0.007522 0.638196 0.560390 O\n0.007522 0.638196 0.939609 O\n0.369326 0.361804 0.060390 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Ga",
"Pb",
"O"
],
"chemical_system": "Ga-O-Pb",
"density": 6.299065412421632,
"density_atomic": 0.064663618301154,
"volume": 216.5050513381209,
"volume_molar": 9.313027817208502,
"formula_full": "Ga4 Pb2 O8",
"formula_reduced": "Ga2PbO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.213939924285714,
"spacegroup": 40
},
{
"id": "jvasp-9770",
"created_at": "2022-09-04T14:38:13.982476Z",
"updated_at": "2022-09-04T14:38:13.982496Z",
"structure_string": "Na2 Nb2 Cu4 S8\n1.0\n5.299724 -0.000000 -1.598049\n0.000000 7.480745 0.000000\n-0.068124 0.000000 9.361028\nNa Nb Cu S\n2 2 4 8\ndirect\n0.720755 0.750000 0.656860 Na\n0.063896 0.250000 0.343140 Na\n0.882723 0.750000 0.228779 Nb\n0.653944 0.250000 0.771221 Nb\n0.748715 0.000000 -0.000000 Cu\n0.748715 0.500000 -0.000000 Cu\n0.375051 0.750000 0.215593 Cu\n0.159459 0.250000 0.784408 Cu\n0.238224 0.750000 0.430314 S\n0.807910 0.250000 0.569687 S\n0.629046 0.001070 0.217915 S\n0.411132 -0.001070 0.782085 S\n0.001898 0.250000 0.991350 S\n0.010548 0.750000 0.008650 S\n0.411132 0.501070 0.782085 S\n0.629046 0.498930 0.217915 S\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Na",
"Nb",
"Cu",
"S"
],
"chemical_system": "Cu-Na-Nb-S",
"density": 3.3294753205956664,
"density_atomic": 0.04320682881978197,
"volume": 370.3118335005994,
"volume_molar": 13.93793741521433,
"formula_full": "Na2 Nb2 Cu4 S8",
"formula_reduced": "NaNb(CuS2)2",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.5781586625,
"spacegroup": 40
},
{
"id": "jvasp-53204",
"created_at": "2022-09-04T14:38:14.275875Z",
"updated_at": "2022-09-04T14:38:14.275900Z",
"structure_string": "Rb4 Se2 O8\n1.0\n6.201221 -0.093346 0.062901\n-3.181450 5.510433 -0.125800\n-0.083332 0.144335 8.419878\nRb Se O\n4 2 8\ndirect\n0.000008 0.004739 0.505346 Rb\n-0.000008 0.004731 0.005345 Rb\n0.383025 0.702689 0.755349 Rb\n0.616975 0.319662 0.255349 Rb\n0.301232 0.648543 0.255352 Se\n0.698768 0.347311 0.755352 Se\n0.132869 0.787729 0.255376 O\n0.101261 0.344151 0.255341 O\n0.482580 0.726993 0.093899 O\n0.482596 0.726941 0.416797 O\n0.517405 0.244345 0.916797 O\n0.517420 0.244412 0.593899 O\n0.867132 0.654861 0.755376 O\n0.898740 0.242891 0.755341 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Rb",
"Se",
"O"
],
"chemical_system": "O-Rb-Se",
"density": 3.6535342844354175,
"density_atomic": 0.04906595115144766,
"volume": 285.33024778807203,
"volume_molar": 12.273563680467488,
"formula_full": "Rb4 Se2 O8",
"formula_reduced": "Rb2SeO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.280965338095238,
"spacegroup": 40
},
{
"id": "jvasp-26740",
"created_at": "2022-09-04T14:38:29.499278Z",
"updated_at": "2022-09-04T14:38:29.499298Z",
"structure_string": "Sn4 P2 Cl2 O8\n1.0\n4.773511 0.000000 0.000000\n-2.386756 4.468739 0.000000\n0.000000 0.000000 13.403598\nSn P Cl O\n4 2 2 8\ndirect\n0.224491 0.393170 0.109838 Sn\n0.831320 0.606830 0.609838 Sn\n0.831320 0.606830 0.890162 Sn\n0.224491 0.393170 0.390162 Sn\n0.919650 0.730165 0.250000 P\n0.189485 0.269835 0.750000 P\n0.453249 0.000000 0.000000 Cl\n0.453249 0.000000 0.500000 Cl\n0.726888 0.600652 0.153820 O\n0.549858 0.350008 0.750000 O\n0.073047 0.079308 0.250000 O\n0.126236 0.399348 0.846180 O\n0.726888 0.600652 0.346180 O\n0.126236 0.399348 0.653821 O\n0.199850 0.649992 0.250000 O\n0.993738 0.920692 0.750000 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Sn",
"P",
"Cl",
"O"
],
"chemical_system": "Cl-O-P-Sn",
"density": 4.2726654145040115,
"density_atomic": 0.055959737788056886,
"volume": 285.91985295926054,
"volume_molar": 10.76156000374481,
"formula_full": "Sn4 P2 Cl2 O8",
"formula_reduced": "Sn2PClO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 1.7454208709375,
"spacegroup": 40
}
]
}