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=-nsites&page=423",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nsites&page=421",
"results": [
{
"id": "jvasp-23421",
"created_at": "2022-09-04T14:37:33.039371Z",
"updated_at": "2022-09-04T14:37:33.039396Z",
"structure_string": "Sm4 Fe4 B16\n1.0\n3.462285 0.000000 0.000000\n0.000000 5.955605 0.000000\n0.000000 0.000000 11.524671\nSm Fe B\n4 4 16\ndirect\n0.000000 0.374773 0.650633 Sm\n0.000000 0.625228 0.349367 Sm\n0.000000 0.874774 0.849367 Sm\n0.000000 0.125227 0.150633 Sm\n0.000000 0.368351 0.912386 Fe\n0.000000 0.631650 0.087614 Fe\n0.000000 0.868351 0.587614 Fe\n0.000000 0.131650 0.412386 Fe\n0.500001 0.641714 0.532173 B\n0.500001 0.358287 0.467827 B\n0.500001 0.221406 0.817682 B\n0.500001 0.778595 0.182318 B\n0.500001 0.721406 0.682318 B\n0.500001 0.278594 0.317682 B\n0.500001 0.389764 0.045118 B\n0.500001 0.475762 0.188380 B\n0.500001 0.889764 0.454882 B\n0.500001 0.110236 0.545118 B\n0.500001 0.858287 0.032173 B\n0.500001 0.524239 0.811620 B\n0.500001 0.975762 0.311620 B\n0.500001 0.024239 0.688379 B\n0.500001 0.610237 0.954882 B\n0.500001 0.141714 0.967827 B\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Sm",
"Fe",
"B"
],
"chemical_system": "B-Fe-Sm",
"density": 6.972260736790366,
"density_atomic": 0.10099363538089876,
"volume": 237.63873742621206,
"volume_molar": 5.9628913617055375,
"formula_full": "Sm4 Fe4 B16",
"formula_reduced": "SmFeB4",
"formula_anonymous": "ABC4",
"energy_above_hull": 4.137177451388889,
"spacegroup": 55
},
{
"id": "jvasp-42370",
"created_at": "2022-09-04T14:37:28.845296Z",
"updated_at": "2022-09-04T14:37:28.845319Z",
"structure_string": "Fe8 O12 F4\n1.0\n0.000000 -0.000000 -5.780669\n4.603219 4.603219 0.000000\n4.312315 -4.312315 2.890335\nFe O F\n8 12 4\ndirect\n0.500045 0.031707 0.000091 Fe\n0.000045 0.968294 0.000091 Fe\n0.749965 0.500000 0.999932 Fe\n0.249965 0.500000 0.999932 Fe\n0.500033 -0.000000 0.500066 Fe\n0.000033 0.000000 0.500066 Fe\n0.749954 0.531707 0.499908 Fe\n0.249954 0.468293 0.499908 Fe\n0.751763 0.809698 0.503528 O\n0.597875 0.500000 0.695752 O\n0.097875 0.500000 0.695752 O\n0.902213 0.500000 0.304426 O\n0.402213 0.500000 0.304426 O\n0.152123 0.000000 0.804247 O\n0.251763 0.190302 0.503528 O\n0.998235 0.690302 0.996470 O\n0.498235 0.309698 0.996470 O\n0.847786 -0.000000 0.195574 O\n0.347786 -0.000000 0.195574 O\n0.652123 -0.000000 0.804247 O\n0.748247 0.224279 0.496495 F\n0.001753 0.275721 0.003505 F\n0.501753 0.724279 0.003505 F\n0.248246 0.775722 0.496495 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-O",
"density": 5.171551686072826,
"density_atomic": 0.10457575997586101,
"volume": 229.49869076294416,
"volume_molar": 5.758639250042339,
"formula_full": "Fe8 O12 F4",
"formula_reduced": "Fe2O3F",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.314663630416667,
"spacegroup": 64
},
{
"id": "jvasp-57849",
"created_at": "2022-09-04T14:37:15.525527Z",
"updated_at": "2022-09-04T14:37:15.525552Z",
"structure_string": "Na2 Li2 Y4 F16\n1.0\n0.000000 6.708444 0.013017\n7.051249 0.000000 0.000000\n0.000000 -1.546138 -6.527668\nNa Li Y F\n2 2 4 16\ndirect\n0.338569 0.250000 0.338593 Na\n0.661430 0.750000 0.661407 Na\n0.000000 0.000000 0.000000 Li\n0.000000 0.500000 0.000000 Li\n0.450163 0.750000 0.077402 Y\n0.077403 0.750000 0.450157 Y\n0.549836 0.250000 0.922597 Y\n0.922596 0.250000 0.549843 Y\n0.607038 0.250000 0.607035 F\n0.062334 0.448764 0.336530 F\n0.085421 0.750000 0.085421 F\n0.937665 0.948764 0.663469 F\n0.392961 0.750000 0.392965 F\n0.914578 0.250000 0.914579 F\n0.745837 0.750000 0.310784 F\n0.336548 0.448761 0.062360 F\n0.937665 0.551237 0.663469 F\n0.689228 0.250000 0.254163 F\n0.663451 0.948761 0.937640 F\n0.663451 0.551239 0.937640 F\n0.254163 0.250000 0.689216 F\n0.310771 0.750000 0.745837 F\n0.336548 0.051239 0.062360 F\n0.062334 0.051237 0.336530 F\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Na",
"Li",
"Y",
"F"
],
"chemical_system": "F-Li-Na-Y",
"density": 3.8708747756198703,
"density_atomic": 0.07776156298338907,
"volume": 308.635771700303,
"volume_molar": 7.7443669197935385,
"formula_full": "Na2 Li2 Y4 F16",
"formula_reduced": "NaLiY2F8",
"formula_anonymous": "ABC2D8",
"energy_above_hull": 0.2181016322916664,
"spacegroup": 63
},
{
"id": "jvasp-29524",
"created_at": "2022-09-04T14:37:08.523056Z",
"updated_at": "2022-09-04T14:37:08.523077Z",
"structure_string": "V4 Te4 O16\n1.0\n4.347808 0.021049 0.000000\n-0.136900 5.449298 0.000000\n0.000000 0.000000 13.481009\nV Te O\n4 4 16\ndirect\n0.332026 0.833343 0.660069 V\n0.667975 0.166658 0.339931 V\n0.667975 0.666658 0.160069 V\n0.332026 0.333343 0.839931 V\n0.047655 0.648926 0.390446 Te\n0.047655 0.148926 0.109554 Te\n0.952345 0.851074 0.890446 Te\n0.952345 0.351074 0.609554 Te\n0.711751 0.322227 0.835376 O\n0.185064 0.127564 0.952846 O\n0.288249 0.677774 0.164624 O\n0.288249 0.177773 0.335376 O\n0.745538 0.380579 0.079260 O\n0.254463 0.619422 0.920740 O\n0.792863 0.484803 0.276897 O\n0.207137 0.015197 0.776897 O\n0.814936 0.372436 0.452846 O\n0.792863 0.984803 0.223103 O\n0.814936 0.872437 0.047154 O\n0.711751 0.822227 0.664624 O\n0.745538 0.880579 0.420740 O\n0.185064 0.627564 0.547154 O\n0.207137 0.515197 0.723104 O\n0.254463 0.119421 0.579260 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"V",
"Te",
"O"
],
"chemical_system": "O-Te-V",
"density": 5.043182891527153,
"density_atomic": 0.07513202760716721,
"volume": 319.4376721134906,
"volume_molar": 8.015410939642363,
"formula_full": "V4 Te4 O16",
"formula_reduced": "VTeO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.4549743277777782,
"spacegroup": 14
},
{
"id": "jvasp-19302",
"created_at": "2022-09-04T14:37:16.346309Z",
"updated_at": "2022-09-04T14:37:16.346336Z",
"structure_string": "Mn4 Zn6 O14\n1.0\n5.143257 0.000000 -0.000000\n0.000000 4.913722 -1.325397\n-0.000000 -0.117784 9.334493\nMn Zn O\n4 6 14\ndirect\n0.752170 0.351290 0.204095 Mn\n0.252170 0.648710 0.795905 Mn\n0.252170 0.852803 0.204094 Mn\n0.752170 0.147197 0.795905 Mn\n0.709313 0.750729 -0.000000 Zn\n0.209313 0.249270 -0.000000 Zn\n0.805825 0.563853 0.605226 Zn\n0.305825 0.436147 0.394773 Zn\n0.805825 0.958626 0.394773 Zn\n0.305825 0.041374 0.605226 Zn\n0.316103 0.633020 -0.000000 O\n0.816104 0.366980 -0.000000 O\n0.437028 0.144444 0.153404 O\n0.937029 0.855557 0.846595 O\n0.058678 0.565636 0.260946 O\n0.558678 0.434365 0.739054 O\n0.193594 0.061521 0.403463 O\n0.058678 0.304689 0.739054 O\n0.693594 0.341944 0.403463 O\n0.193594 0.658056 0.596536 O\n0.937029 0.008961 0.153404 O\n0.693594 0.938479 0.596536 O\n0.558678 0.695311 0.260945 O\n0.437028 0.991040 0.846595 O\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Mn",
"Zn",
"O"
],
"chemical_system": "Mn-O-Zn",
"density": 5.906078643326651,
"density_atomic": 0.1020827496825955,
"volume": 235.10338499524036,
"volume_molar": 5.899273656640872,
"formula_full": "Mn4 Zn6 O14",
"formula_reduced": "Mn2Zn3O7",
"formula_anonymous": "A2B3C7",
"energy_above_hull": 1.957221681896552,
"spacegroup": 36
},
{
"id": "jvasp-50801",
"created_at": "2022-09-04T14:37:08.084739Z",
"updated_at": "2022-09-04T14:37:08.084760Z",
"structure_string": "Li12 Cu4 S8\n1.0\n-3.927884 3.927884 5.969496\n3.927884 -3.927884 5.969496\n3.927884 3.927884 -5.969496\nLi Cu S\n12 4 8\ndirect\n0.843759 0.156241 0.250000 Li\n0.406240 0.156240 0.812482 Li\n0.593759 0.406240 0.749999 Li\n0.156240 0.406240 0.312483 Li\n-0.000000 -0.000000 0.499999 Li\n0.000000 0.500000 0.000000 Li\n0.156240 0.843759 0.749999 Li\n0.406241 0.593760 0.250000 Li\n0.843759 0.593760 0.687516 Li\n0.499999 0.000000 0.499999 Li\n0.000000 0.000000 0.000000 Li\n0.593760 0.843760 0.187517 Li\n0.246865 0.496865 0.749999 Cu\n0.503134 0.753134 0.749999 Cu\n0.496866 0.246866 0.250000 Cu\n0.753134 0.503135 0.250000 Cu\n0.210702 0.232844 0.977858 S\n0.789298 0.767156 0.022141 S\n0.754985 0.232845 0.522140 S\n0.232844 0.210703 0.477859 S\n0.767155 0.245015 0.977858 S\n0.232845 0.754985 0.022141 S\n0.767156 0.789297 0.522140 S\n0.245015 0.767155 0.477859 S\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Li",
"Cu",
"S"
],
"chemical_system": "Cu-Li-S",
"density": 2.6774270946365157,
"density_atomic": 0.0651472784763978,
"volume": 368.39604909505096,
"volume_molar": 9.243886929492781,
"formula_full": "Li12 Cu4 S8",
"formula_reduced": "Li3CuS2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.8256784083333335,
"spacegroup": 141
},
{
"id": "jvasp-39462",
"created_at": "2022-09-04T14:38:03.573350Z",
"updated_at": "2022-09-04T14:38:03.573371Z",
"structure_string": "Ho4 B16 Ru4\n1.0\n3.567102 0.000000 0.000000\n0.000000 5.938574 0.000000\n0.000000 0.000000 11.485547\nHo B Ru\n4 16 4\ndirect\n0.000000 0.128511 0.149935 Ho\n0.000000 0.871489 0.850065 Ho\n0.000000 0.628510 0.350065 Ho\n0.000000 0.371489 0.649935 Ho\n0.500000 0.112214 0.546769 B\n0.500000 0.887785 0.453231 B\n0.500000 0.612214 0.953231 B\n0.500000 0.387786 0.046769 B\n0.500000 0.135833 0.969954 B\n0.500000 0.864167 0.030046 B\n0.500000 0.635832 0.530046 B\n0.500000 0.364167 0.469954 B\n0.500000 0.210523 0.814306 B\n0.500000 0.789477 0.185694 B\n0.500000 0.710523 0.685694 B\n0.500000 0.289477 0.314306 B\n0.500000 0.024729 0.691857 B\n0.500000 0.975271 0.308144 B\n0.500000 0.524728 0.808144 B\n0.500000 0.475271 0.191857 B\n0.000000 0.140686 0.406974 Ru\n0.000000 0.859313 0.593026 Ru\n0.000000 0.640686 0.093026 Ru\n0.000000 0.359314 0.906974 Ru\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Ho",
"B",
"Ru"
],
"chemical_system": "B-Ho-Ru",
"density": 8.442312743291428,
"density_atomic": 0.09864199742962887,
"volume": 243.30407560047215,
"volume_molar": 6.105047461448853,
"formula_full": "Ho4 B16 Ru4",
"formula_reduced": "HoB4Ru",
"formula_anonymous": "ABC4",
"energy_above_hull": 4.2940794,
"spacegroup": 55
},
{
"id": "jvasp-25637",
"created_at": "2022-09-04T14:37:42.519978Z",
"updated_at": "2022-09-04T14:37:42.519991Z",
"structure_string": "Tm4 Se4 O12 F4\n1.0\n0.000000 6.549535 0.020355\n6.832595 0.000000 0.000000\n0.000000 -1.051965 -7.000321\nTm Se O F\n4 4 12 4\ndirect\n0.864015 0.858424 0.175138 Tm\n0.135987 0.141577 0.824862 Tm\n0.864015 0.641577 0.675138 Tm\n0.135986 0.358423 0.324862 Tm\n0.356562 0.882153 0.291985 Se\n0.356562 0.617848 0.791985 Se\n0.643440 0.117848 0.708016 Se\n0.643440 0.382153 0.208016 Se\n0.176435 0.806930 0.782336 O\n0.481409 0.311942 0.363621 O\n0.481409 0.188059 0.863621 O\n0.826107 0.966463 0.852978 O\n0.518593 0.688059 0.636379 O\n0.176435 0.693071 0.282336 O\n0.823567 0.306930 0.717665 O\n0.518593 0.811942 0.136379 O\n0.823566 0.193070 0.217665 O\n0.826106 0.533538 0.352978 O\n0.173895 0.466462 0.647022 O\n0.173895 0.033538 0.147022 O\n0.166229 0.113457 0.524874 F\n0.833773 0.613457 0.975126 F\n0.166229 0.386543 0.024874 F\n0.833772 0.886544 0.475126 F\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Tm",
"Se",
"O",
"F"
],
"chemical_system": "F-O-Se-Tm",
"density": 6.679713778666059,
"density_atomic": 0.07664785685568512,
"volume": 313.12030087400774,
"volume_molar": 7.8568938611534405,
"formula_full": "Tm4 Se4 O12 F4",
"formula_reduced": "TmSeO3F",
"formula_anonymous": "ABCD3",
"energy_above_hull": 1.387531399861111,
"spacegroup": 14
},
{
"id": "jvasp-25802",
"created_at": "2022-09-04T14:37:42.381929Z",
"updated_at": "2022-09-04T14:37:42.381943Z",
"structure_string": "Y6 Cu2 Ge2 S14\n1.0\n4.931817 -8.542158 0.000000\n4.931817 8.542158 0.000000\n0.000000 -0.000000 5.807487\nY Cu Ge S\n6 2 2 14\ndirect\n0.133986 0.776074 0.751383 Y\n0.776074 0.642088 0.251383 Y\n0.357912 0.133986 0.251383 Y\n0.642088 0.866015 0.751383 Y\n0.866014 0.223927 0.251383 Y\n0.223926 0.357912 0.751383 Y\n0.000000 0.000000 0.195088 Cu\n0.000000 0.000000 0.695088 Cu\n0.666667 0.333333 0.831779 Ge\n0.333333 0.666667 0.331779 Ge\n0.422935 0.903430 0.494489 S\n0.160085 0.260526 0.215142 S\n0.260526 0.100441 0.715143 S\n0.577066 0.096570 0.994489 S\n0.666667 0.333333 0.451695 S\n0.739475 0.899560 0.215142 S\n0.903430 0.480496 0.994489 S\n0.096570 0.519505 0.494489 S\n0.100441 0.839915 0.215142 S\n0.899560 0.160085 0.715143 S\n0.839915 0.739475 0.715143 S\n0.480496 0.577066 0.494489 S\n0.333333 0.666667 0.951695 S\n0.519505 0.422935 0.994489 S\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Y",
"Cu",
"Ge",
"S"
],
"chemical_system": "Cu-Ge-S-Y",
"density": 4.257965310691683,
"density_atomic": 0.04904767736608127,
"volume": 489.3198065398528,
"volume_molar": 12.27813646516234,
"formula_full": "Y6 Cu2 Ge2 S14",
"formula_reduced": "Y3CuGeS7",
"formula_anonymous": "ABC3D7",
"energy_above_hull": 2.1415193958333334,
"spacegroup": 173
},
{
"id": "jvasp-25696",
"created_at": "2022-09-04T14:37:42.733893Z",
"updated_at": "2022-09-04T14:37:42.733916Z",
"structure_string": "Nd6 Cu2 Si2 S14\n1.0\n5.092428 -8.820344 -0.000000\n5.092428 8.820344 -0.000000\n-0.000000 0.000000 5.777818\nNd Cu Si S\n6 2 2 14\ndirect\n0.232084 0.874689 0.747782 Nd\n0.357395 0.232083 0.247782 Nd\n0.125311 0.357394 0.747782 Nd\n0.767917 0.125312 0.247782 Nd\n0.874689 0.642606 0.247782 Nd\n0.642606 0.767917 0.747782 Nd\n0.000000 0.000000 0.223546 Cu\n0.000000 0.000000 0.723546 Cu\n0.666667 0.333333 0.832256 Si\n0.333333 0.666667 0.332255 Si\n0.888849 0.413200 0.976028 S\n0.413200 0.524350 0.476028 S\n0.746477 0.834878 0.233668 S\n0.586801 0.475650 0.976028 S\n0.333333 0.666667 0.966468 S\n0.911599 0.746477 0.733669 S\n0.834878 0.088402 0.733669 S\n0.165123 0.911599 0.233668 S\n0.475650 0.888849 0.476028 S\n0.111151 0.586801 0.476028 S\n0.088401 0.253524 0.233668 S\n0.524350 0.111151 0.976028 S\n0.666667 0.333333 0.466468 S\n0.253524 0.165122 0.733669 S\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Nd",
"Cu",
"Si",
"S"
],
"chemical_system": "Cu-Nd-S-Si",
"density": 4.79123976777046,
"density_atomic": 0.04623884399322059,
"volume": 519.0441180475622,
"volume_molar": 13.023986414718648,
"formula_full": "Nd6 Cu2 Si2 S14",
"formula_reduced": "Nd3CuSiS7",
"formula_anonymous": "ABC3D7",
"energy_above_hull": 1.982540295833333,
"spacegroup": 173
},
{
"id": "jvasp-25648",
"created_at": "2022-09-04T14:37:43.267262Z",
"updated_at": "2022-09-04T14:37:43.267279Z",
"structure_string": "Rb4 Fe4 F16\n1.0\n6.249353 -0.000000 0.000000\n-0.000000 7.348748 0.000000\n0.000000 0.000000 7.393282\nRb Fe F\n4 4 16\ndirect\n0.465405 0.270075 0.250000 Rb\n0.465405 0.229925 0.750000 Rb\n0.534595 0.770075 0.250000 Rb\n0.534595 0.729925 0.750000 Rb\n0.000000 0.000000 0.000000 Fe\n0.000000 0.500000 0.000000 Fe\n0.000000 0.500000 0.500000 Fe\n0.000000 0.000000 0.500000 Fe\n0.065966 0.515231 0.750000 F\n0.065966 0.984770 0.250000 F\n0.080996 0.250000 0.500000 F\n0.919003 0.750000 0.000000 F\n0.919003 0.750000 0.500000 F\n0.080996 0.250000 0.000000 F\n0.714828 0.049376 0.038425 F\n0.285172 0.950625 0.961574 F\n0.285172 0.549376 0.461575 F\n0.285172 0.950625 0.538425 F\n0.934034 0.484769 0.250000 F\n0.285172 0.549376 0.038425 F\n0.714828 0.450625 0.538425 F\n0.714828 0.049376 0.461575 F\n0.714828 0.450625 0.961574 F\n0.934034 0.015231 0.750000 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Rb",
"Fe",
"F"
],
"chemical_system": "F-Fe-Rb",
"density": 4.25104740489081,
"density_atomic": 0.07068472263290371,
"volume": 339.5358870493468,
"volume_molar": 8.519720437010948,
"formula_full": "Rb4 Fe4 F16",
"formula_reduced": "RbFeF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.120864038611111,
"spacegroup": 57
},
{
"id": "jvasp-23849",
"created_at": "2022-09-04T14:37:41.843847Z",
"updated_at": "2022-09-04T14:37:41.843878Z",
"structure_string": "Sm4 Mn4 B16\n1.0\n3.497428 0.000000 0.000000\n0.000000 5.957526 -0.000000\n0.000000 -0.000000 11.524372\nSm Mn B\n4 4 16\ndirect\n0.000000 0.376494 0.651045 Sm\n0.000000 0.623507 0.348955 Sm\n0.000000 0.876494 0.848955 Sm\n0.000000 0.123506 0.151045 Sm\n0.000000 0.376426 0.918165 Mn\n0.000000 0.623574 0.081834 Mn\n0.000000 0.876427 0.581834 Mn\n0.000000 0.123574 0.418166 Mn\n0.500000 0.641638 0.532759 B\n0.500000 0.358363 0.467241 B\n0.500000 0.222764 0.818014 B\n0.500000 0.777237 0.181986 B\n0.500000 0.722764 0.681986 B\n0.500000 0.277236 0.318014 B\n0.500000 0.111374 0.545569 B\n0.500000 0.475418 0.188841 B\n0.500000 0.611375 0.954431 B\n0.500000 0.388626 0.045569 B\n0.500000 0.858363 0.032759 B\n0.500000 0.524582 0.811159 B\n0.500000 0.975419 0.311159 B\n0.500000 0.024582 0.688841 B\n0.500000 0.888626 0.454431 B\n0.500000 0.141637 0.967241 B\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Sm",
"Mn",
"B"
],
"chemical_system": "B-Mn-Sm",
"density": 6.875067374854616,
"density_atomic": 0.09994918199091679,
"volume": 240.1220252325935,
"volume_molar": 6.025202648028957,
"formula_full": "Sm4 Mn4 B16",
"formula_reduced": "SmMnB4",
"formula_anonymous": "ABC4",
"energy_above_hull": 4.281686074952108,
"spacegroup": 55
}
]
}