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=-id&page=166",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-id&page=164",
"results": [
{
"id": "jvasp-9608",
"created_at": "2022-09-04T14:38:12.192753Z",
"updated_at": "2022-09-04T14:38:12.192763Z",
"structure_string": "Na2 N2 O6\n1.0\n4.595346 -0.062107 4.115949\n1.800963 4.228191 4.115949\n-0.095355 -0.062107 6.168399\nNa N O\n2 2 6\ndirect\n0.500001 0.499999 0.500000 Na\n0.000000 0.000000 0.000000 Na\n0.750001 0.749999 0.750000 N\n0.250000 0.250000 0.250000 N\n0.750000 0.502622 -0.002623 O\n-0.002623 0.750000 0.502623 O\n0.497378 0.002623 0.250000 O\n0.250000 0.497377 0.002623 O\n0.002624 0.250000 0.497377 O\n0.502625 -0.002624 0.750000 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Na",
"N",
"O"
],
"chemical_system": "N-Na-O",
"density": 2.2960279673236323,
"density_atomic": 0.0813404165815816,
"volume": 122.94011292615336,
"volume_molar": 7.4036266509159105,
"formula_full": "Na2 N2 O6",
"formula_reduced": "NaNO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.28726055,
"spacegroup": 167
},
{
"id": "jvasp-96077",
"created_at": "2022-09-04T14:36:07.481732Z",
"updated_at": "2022-09-04T14:36:07.481772Z",
"structure_string": "K12 Pb4 O10\n1.0\n6.357996 -0.020753 0.664292\n0.109437 7.470440 1.471097\n-0.008186 -0.025274 12.495587\nK Pb O\n12 4 10\ndirect\n0.781015 0.701710 0.124766 K\n0.588796 0.867219 0.625940 K\n0.411204 0.132782 0.374060 K\n0.218985 0.298291 0.875234 K\n0.435440 0.609904 0.364773 K\n0.564561 0.390096 0.635228 K\n0.920242 0.407940 0.384289 K\n0.079759 0.592060 0.615711 K\n0.315826 0.950149 0.122717 K\n0.684174 0.049852 0.877283 K\n0.304481 0.484735 0.123597 K\n0.695519 0.515266 0.876403 K\n0.915370 0.873001 0.355346 Pb\n0.237098 0.788747 0.865368 Pb\n0.762903 0.211254 0.134632 Pb\n0.084631 0.127000 0.644655 Pb\n0.646288 0.946705 0.244271 O\n0.353712 0.053296 0.755729 O\n0.516236 0.243799 0.024111 O\n0.483764 0.756202 0.975889 O\n0.746163 0.673840 0.480771 O\n0.253837 0.326161 0.519229 O\n0.622256 0.385212 0.242835 O\n0.377745 0.614789 0.757165 O\n0.084016 0.693395 0.258013 O\n0.915984 0.306606 0.741987 O\n",
"nsites": 26,
"nelements": 3,
"elements": [
"K",
"Pb",
"O"
],
"chemical_system": "K-O-Pb",
"density": 4.077119194249213,
"density_atomic": 0.04378526661801967,
"volume": 593.8070499107065,
"volume_molar": 13.753806303240848,
"formula_full": "K12 Pb4 O10",
"formula_reduced": "K6Pb2O5",
"formula_anonymous": "A2B5C6",
"energy_above_hull": 0.5506259338461538,
"spacegroup": 2
},
{
"id": "jvasp-96074",
"created_at": "2022-09-04T14:36:05.113860Z",
"updated_at": "2022-09-04T14:36:05.113887Z",
"structure_string": "Y6 Al4 Ni12\n1.0\n7.298979 -0.000000 -2.580579\n-3.649490 6.321102 -2.580579\n0.000000 0.000000 7.741737\nY Al Ni\n6 4 12\ndirect\n0.293693 -0.000000 0.293693 Y\n0.706307 -0.000000 0.706307 Y\n0.706307 0.706307 -0.000000 Y\n-0.000000 0.706307 0.706307 Y\n0.293693 0.293693 -0.000000 Y\n-0.000000 0.293693 0.293693 Y\n-0.000000 -0.000000 0.500000 Al\n0.500000 0.500000 0.500000 Al\n0.500000 0.000000 -0.000000 Al\n-0.000000 0.500000 -0.000000 Al\n0.333969 0.666985 0.666985 Ni\n0.666985 -0.000000 0.333015 Ni\n0.666985 0.333015 -0.000000 Ni\n-0.000000 0.333015 0.666985 Ni\n0.666031 0.333015 0.333015 Ni\n0.333015 -0.000000 0.666985 Ni\n0.333015 0.333015 0.666031 Ni\n0.333015 0.666031 0.333015 Ni\n0.333015 0.666985 -0.000000 Ni\n0.666985 0.666985 0.333969 Ni\n-0.000000 0.666985 0.333015 Ni\n0.666985 0.333969 0.666985 Ni\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Y",
"Al",
"Ni"
],
"chemical_system": "Al-Ni-Y",
"density": 6.2560214958781115,
"density_atomic": 0.0615927159452824,
"volume": 357.18509343774207,
"volume_molar": 9.777358682071979,
"formula_full": "Y6 Al4 Ni12",
"formula_reduced": "Y3(AlNi3)2",
"formula_anonymous": "A2B3C6",
"energy_above_hull": 1.961431486363636,
"spacegroup": 229
},
{
"id": "jvasp-96072",
"created_at": "2022-09-04T14:36:01.445126Z",
"updated_at": "2022-09-04T14:36:01.445151Z",
"structure_string": "Ba2 Al4 Cl16\n1.0\n7.199588 0.000000 0.000000\n0.000000 7.225849 -1.566906\n0.000000 -0.042752 12.543314\nBa Al Cl\n2 4 16\ndirect\n0.136396 0.500000 0.250000 Ba\n0.863604 0.500000 0.750000 Ba\n0.283094 0.710924 0.946239 Al\n0.283094 0.289077 0.553760 Al\n0.716906 0.289077 0.053761 Al\n0.716906 0.710924 0.446239 Al\n0.794209 0.579155 0.101766 Cl\n0.205791 0.420846 0.898233 Cl\n0.205791 0.579155 0.601766 Cl\n0.442860 0.242613 0.111897 Cl\n0.442860 0.757388 0.388102 Cl\n0.557140 0.757388 0.888102 Cl\n0.557140 0.242613 0.611897 Cl\n0.919050 0.862682 0.373080 Cl\n0.080950 0.862682 0.873080 Cl\n0.714305 0.206958 0.877784 Cl\n0.714305 0.793042 0.622215 Cl\n0.285695 0.793042 0.122215 Cl\n0.285695 0.206958 0.377784 Cl\n0.794209 0.420846 0.398233 Cl\n0.919050 0.137318 0.126919 Cl\n0.080950 0.137318 0.626919 Cl\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Ba",
"Al",
"Cl"
],
"chemical_system": "Al-Ba-Cl",
"density": 2.4188359666470327,
"density_atomic": 0.0337392141188067,
"volume": 652.060238348495,
"volume_molar": 17.84908426969903,
"formula_full": "Ba2 Al4 Cl16",
"formula_reduced": "Ba(AlCl4)2",
"formula_anonymous": "AB2C8",
"energy_above_hull": 0.2575485554545454,
"spacegroup": 13
},
{
"id": "jvasp-96071",
"created_at": "2022-09-04T14:35:58.529860Z",
"updated_at": "2022-09-04T14:35:58.529884Z",
"structure_string": "Eu2 Al4 Cl16\n1.0\n6.800734 0.000000 0.000000\n0.000000 6.444818 -0.346929\n0.000000 0.285827 12.999106\nEu Al Cl\n2 4 16\ndirect\n0.175887 0.500000 0.250000 Eu\n0.824112 0.500001 0.750000 Eu\n0.258048 0.665561 0.912429 Al\n0.258048 0.334440 0.587571 Al\n0.741952 0.334440 0.087571 Al\n0.741952 0.665561 0.412429 Al\n0.845572 0.645287 0.128530 Cl\n0.154427 0.354714 0.871470 Cl\n0.154427 0.645287 0.628530 Cl\n0.491510 0.233518 0.178309 Cl\n0.491510 0.766483 0.321692 Cl\n0.508489 0.766483 0.821692 Cl\n0.508489 0.233518 0.678309 Cl\n0.001459 0.840974 0.371338 Cl\n0.998540 0.840975 0.871339 Cl\n0.660984 0.289085 0.926976 Cl\n0.660984 0.710916 0.573024 Cl\n0.339015 0.710916 0.073024 Cl\n0.339015 0.289085 0.426976 Cl\n0.845572 0.354714 0.371470 Cl\n0.001459 0.159026 0.128662 Cl\n0.998540 0.159026 0.628662 Cl\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Eu",
"Al",
"Cl"
],
"chemical_system": "Al-Cl-Eu",
"density": 2.850253109249881,
"density_atomic": 0.03856816755995973,
"volume": 570.4185962633006,
"volume_molar": 15.614277630996392,
"formula_full": "Eu2 Al4 Cl16",
"formula_reduced": "Eu(AlCl4)2",
"formula_anonymous": "AB2C8",
"energy_above_hull": 0.4725125581818182,
"spacegroup": 13
},
{
"id": "jvasp-9607",
"created_at": "2022-09-04T14:38:13.959670Z",
"updated_at": "2022-09-04T14:38:13.959694Z",
"structure_string": "Cd4 Si2 O8\n1.0\n5.652743 -0.026828 -1.363987\n-3.022367 4.776978 -1.363987\n-0.013205 -0.023847 6.713524\nCd Si O\n4 2 8\ndirect\n0.807896 0.192101 0.749999 Cd\n0.442101 0.557897 0.749999 Cd\n0.192101 0.807898 0.249999 Cd\n0.557897 0.442102 0.249999 Cd\n0.124999 0.875000 0.749999 Si\n0.874999 0.125000 0.249999 Si\n0.249869 0.208475 0.898109 O\n0.310364 0.851761 0.601889 O\n0.791522 0.750129 0.601888 O\n0.148238 0.689634 0.898109 O\n0.750129 0.791524 0.101889 O\n0.689633 0.148239 0.398109 O\n0.851760 0.310365 0.101889 O\n0.208475 0.249870 0.398110 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Cd",
"Si",
"O"
],
"chemical_system": "Cd-O-Si",
"density": 5.834963973632426,
"density_atomic": 0.07761718594500586,
"volume": 180.3724243483837,
"volume_molar": 7.7587723474887,
"formula_full": "Cd4 Si2 O8",
"formula_reduced": "Cd2SiO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.1811760142857135,
"spacegroup": 70
},
{
"id": "jvasp-96069",
"created_at": "2022-09-04T14:35:56.048133Z",
"updated_at": "2022-09-04T14:35:56.048157Z",
"structure_string": "Ba4 Pt8 S12\n1.0\n6.830992 0.000000 0.000000\n0.000000 6.830992 0.000000\n0.000000 0.000000 12.443571\nBa Pt S\n4 8 12\ndirect\n0.325283 0.325283 0.500000 Ba\n0.825283 0.174717 0.250000 Ba\n0.174717 0.825283 0.750000 Ba\n0.674717 0.674717 0.000000 Ba\n0.250215 0.992612 0.124744 Pt\n0.492612 0.249785 0.874744 Pt\n0.750215 0.507388 0.625256 Pt\n0.249785 0.492612 0.125256 Pt\n0.007388 0.749785 0.375256 Pt\n0.992612 0.250215 0.875256 Pt\n0.749785 0.007388 0.624744 Pt\n0.507388 0.750215 0.374744 Pt\n0.257132 0.840068 0.496467 S\n0.743517 0.256483 0.750000 S\n0.756483 0.756483 0.500000 S\n0.243517 0.243517 0.000000 S\n0.757132 0.659932 0.253533 S\n0.242868 0.340068 0.753533 S\n0.659932 0.757132 0.746467 S\n0.340068 0.242868 0.246467 S\n0.840068 0.257132 0.503533 S\n0.742868 0.159932 0.996467 S\n0.256483 0.743517 0.250000 S\n0.159932 0.742868 0.003533 S\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Ba",
"Pt",
"S"
],
"chemical_system": "Ba-Pt-S",
"density": 7.134528645952261,
"density_atomic": 0.04133316465906898,
"volume": 580.6475308135914,
"volume_molar": 14.56975484377452,
"formula_full": "Ba4 Pt8 S12",
"formula_reduced": "BaPt2S3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.8008397949999997,
"spacegroup": 92
},
{
"id": "jvasp-9606",
"created_at": "2022-09-04T14:38:15.841161Z",
"updated_at": "2022-09-04T14:38:15.841174Z",
"structure_string": "Li8 Sn1 O6\n1.0\n4.875259 0.007129 3.516728\n1.803302 4.529492 3.516728\n0.010495 0.007129 6.011274\nLi Sn O\n8 1 6\ndirect\n0.494831 0.100937 0.766227 Li\n0.766227 0.494831 0.100938 Li\n0.100936 0.766227 0.494832 Li\n0.505168 0.899063 0.233774 Li\n0.233772 0.505169 0.899063 Li\n0.899062 0.233773 0.505169 Li\n0.345572 0.345572 0.345572 Li\n0.654427 0.654428 0.654428 Li\n0.000000 0.000000 0.000000 Sn\n0.236585 0.905604 0.612609 O\n0.387391 0.763414 0.094396 O\n0.094395 0.387391 0.763415 O\n0.763414 0.094396 0.387391 O\n0.612608 0.236586 0.905605 O\n0.905604 0.612609 0.236586 O\n",
"nsites": 15,
"nelements": 3,
"elements": [
"Li",
"Sn",
"O"
],
"chemical_system": "Li-O-Sn",
"density": 3.388661408975747,
"density_atomic": 0.11327386150625585,
"volume": 132.42243003406028,
"volume_molar": 5.316443422975751,
"formula_full": "Li8 Sn1 O6",
"formula_reduced": "Li8SnO6",
"formula_anonymous": "AB6C8",
"energy_above_hull": 1.5546308466666667,
"spacegroup": 148
},
{
"id": "jvasp-96052",
"created_at": "2022-09-04T14:35:53.037892Z",
"updated_at": "2022-09-04T14:35:53.037925Z",
"structure_string": "Co4 Ge4 O12\n1.0\n5.086167 -0.010856 0.717142\n0.849917 6.579033 0.522625\n-0.028540 0.048192 6.654024\nCo Ge O\n4 4 12\ndirect\n0.250001 0.741487 0.258513 Co\n0.750000 0.258512 0.741487 Co\n0.750001 0.907280 0.092718 Co\n0.249999 0.092717 0.907281 Co\n0.288226 0.208720 0.397494 Ge\n0.711773 0.791277 0.602506 Ge\n0.788227 0.397493 0.208720 Ge\n0.211774 0.602505 0.791280 Ge\n0.132262 0.795120 0.968456 O\n0.367739 0.031542 0.204880 O\n0.600376 0.291516 0.437461 O\n0.614116 0.630542 0.133983 O\n0.885886 0.866016 0.369457 O\n0.385885 0.369456 0.866017 O\n0.114115 0.133983 0.630543 O\n0.100375 0.437461 0.291516 O\n0.399626 0.708482 0.562539 O\n0.899627 0.562539 0.708483 O\n0.867739 0.204880 0.031543 O\n0.632263 0.968455 0.795120 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Co",
"Ge",
"O"
],
"chemical_system": "Co-Ge-O",
"density": 5.354502214978275,
"density_atomic": 0.08978480689943502,
"volume": 222.75483671086286,
"volume_molar": 6.707304908218157,
"formula_full": "Co4 Ge4 O12",
"formula_reduced": "CoGeO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.14328747,
"spacegroup": 15
},
{
"id": "jvasp-96051",
"created_at": "2022-09-04T14:35:49.216122Z",
"updated_at": "2022-09-04T14:35:49.216146Z",
"structure_string": "Nd4 Co4 O12\n1.0\n5.407935 0.000000 0.000000\n-0.000000 5.369256 0.000000\n0.000000 0.000000 7.597226\nNd Co O\n4 4 12\ndirect\n0.954195 0.009113 0.750000 Nd\n0.545804 0.509114 0.250000 Nd\n0.045804 0.990888 0.250000 Nd\n0.454195 0.490887 0.750000 Nd\n0.000000 0.499999 0.000000 Co\n0.500000 0.000000 0.500000 Co\n0.500000 0.000000 0.000000 Co\n0.000000 0.499999 0.500000 Co\n0.990043 0.424586 0.250000 O\n0.490044 0.075417 0.250000 O\n0.711498 0.289170 0.540043 O\n0.711498 0.289170 0.959958 O\n0.211498 0.210830 0.540043 O\n0.788500 0.789169 0.040042 O\n0.288502 0.710831 0.459958 O\n0.288502 0.710831 0.040042 O\n0.788500 0.789169 0.459958 O\n0.211498 0.210830 0.959958 O\n0.509957 0.924585 0.750000 O\n0.009956 0.575416 0.750000 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Nd",
"Co",
"O"
],
"chemical_system": "Co-Nd-O",
"density": 7.562791102518675,
"density_atomic": 0.09066285179921654,
"volume": 220.59751709875982,
"volume_molar": 6.642346496376193,
"formula_full": "Nd4 Co4 O12",
"formula_reduced": "NdCoO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.10142858,
"spacegroup": 62
},
{
"id": "jvasp-96050",
"created_at": "2022-09-04T14:35:44.858953Z",
"updated_at": "2022-09-04T14:35:44.858978Z",
"structure_string": "Tb4 Co4 O12\n1.0\n5.158183 0.000037 0.000031\n0.000047 5.501720 -0.000077\n-0.000233 0.000042 7.405449\nTb Co O\n4 4 12\ndirect\n0.479738 0.426744 0.750001 Tb\n0.979735 0.073255 0.250001 Tb\n0.520263 0.573257 0.249998 Tb\n0.020266 0.926745 0.749998 Tb\n0.500000 0.000000 0.500000 Co\n0.500000 0.000000 -0.000000 Co\n0.000001 0.500000 0.500000 Co\n0.000000 0.500000 -0.000000 Co\n0.692131 0.300911 0.048765 O\n0.307869 0.699090 0.951234 O\n0.598058 0.025659 0.750002 O\n0.901941 0.525660 0.749998 O\n0.807871 0.800910 0.048767 O\n0.807872 0.800913 0.451232 O\n0.307872 0.699092 0.548765 O\n0.192130 0.199090 0.951233 O\n0.192129 0.199089 0.548768 O\n0.692128 0.300908 0.451233 O\n0.401943 0.974342 0.249998 O\n0.098059 0.474341 0.250002 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Tb",
"Co",
"O"
],
"chemical_system": "Co-O-Tb",
"density": 8.402531450905483,
"density_atomic": 0.095166340720764,
"volume": 210.158338006121,
"volume_molar": 6.328015466802593,
"formula_full": "Tb4 Co4 O12",
"formula_reduced": "TbCoO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.03779196,
"spacegroup": 62
},
{
"id": "jvasp-9605",
"created_at": "2022-09-04T14:38:01.974464Z",
"updated_at": "2022-09-04T14:38:01.974476Z",
"structure_string": "Ag6 Sb2 S6\n1.0\n6.816738 0.199941 -1.548152\n-1.980614 6.525723 -1.548152\n0.143768 0.199941 6.988849\nAg Sb S\n6 2 6\ndirect\n0.421271 0.749486 0.938444 Ag\n0.938445 0.421270 0.749487 Ag\n0.921271 0.438444 0.249487 Ag\n0.438444 0.249486 0.921271 Ag\n0.749487 0.938443 0.421271 Ag\n0.249487 0.921270 0.438444 Ag\n0.510490 0.510489 0.510489 Sb\n0.010489 0.010489 0.010489 Sb\n0.096505 0.763138 0.746565 S\n0.763139 0.746564 0.096505 S\n0.263139 0.596504 0.246565 S\n0.596505 0.246565 0.263139 S\n0.746565 0.096504 0.763139 S\n0.246565 0.263138 0.596505 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Ag",
"Sb",
"S"
],
"chemical_system": "Ag-S-Sb",
"density": 5.659562200733144,
"density_atomic": 0.04405401761357019,
"volume": 317.7916739127899,
"volume_molar": 13.669901376134579,
"formula_full": "Ag6 Sb2 S6",
"formula_reduced": "Ag3SbS3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 1.0316111257142857,
"spacegroup": 161
}
]
}