{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=3380","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=3378","results":[{"id":"jvasp-23378","created_at":"2022-09-04T14:37:34.665298Z","updated_at":"2022-09-04T14:37:34.665317Z","structure_string":"Li4 Ca8 Si12\n1.0\n4.373159 0.000000 0.000000\n0.000000 10.525610 -0.000000\n0.000000 -0.000000 11.212759\nLi Ca Si\n4 8 12\ndirect\n0.500000 0.860821 0.281234 Li\n0.500000 0.139179 0.718766 Li\n0.000000 0.360821 0.218766 Li\n0.000000 0.639179 0.781234 Li\n0.000000 0.321795 0.925445 Ca\n0.500000 0.178204 0.425445 Ca\n0.500000 0.821795 0.574556 Ca\n0.000000 0.678204 0.074555 Ca\n0.000000 0.051331 0.149933 Ca\n0.500000 0.448669 0.649934 Ca\n0.500000 0.551331 0.350067 Ca\n0.000000 0.948669 0.850067 Ca\n0.500000 0.755340 0.864455 Si\n0.500000 0.890817 0.041078 Si\n0.500000 0.109183 0.958922 Si\n0.000000 0.390817 0.458922 Si\n0.000000 0.609183 0.541078 Si\n0.000000 0.967163 0.399711 Si\n0.000000 0.032837 0.600290 Si\n0.500000 0.467163 0.100289 Si\n0.500000 0.532837 0.899711 Si\n0.000000 0.255340 0.635545 Si\n0.000000 0.744660 0.364455 Si\n0.500000 0.244660 0.135545 Si\n","nsites":24,"nelements":3,"elements":["Li","Ca","Si"],"chemical_system":"Ca-Li-Si","density":2.2051952001120836,"density_atomic":0.046500348938097964,"volume":516.1251592315833,"volume_molar":12.950743161125034,"formula_full":"Li4 Ca8 Si12","formula_reduced":"LiCa2Si3","formula_anonymous":"AB2C3","energy_above_hull":1.61904944,"spacegroup":58},{"id":"jvasp-35933","created_at":"2022-09-04T14:37:38.153437Z","updated_at":"2022-09-04T14:37:38.153458Z","structure_string":"Li3 Pr1 Bi2\n1.0\n2.350622 -4.071398 0.000000\n2.350622 4.071398 -0.000000\n-0.000000 -0.000000 7.495755\nLi Pr Bi\n3 1 2\ndirect\n0.333332 0.666667 0.648305 Li\n0.666667 0.333332 0.351694 Li\n0.000000 0.000000 0.500000 Li\n0.000000 0.000000 0.000000 Pr\n0.333332 0.666667 0.256379 Bi\n0.666667 0.333332 0.743621 Bi\n","nsites":6,"nelements":3,"elements":["Li","Pr","Bi"],"chemical_system":"Bi-Li-Pr","density":6.709254376206128,"density_atomic":0.04181956549000895,"volume":143.4735136459859,"volume_molar":14.400294908465131,"formula_full":"Li3 Pr1 Bi2","formula_reduced":"Li3PrBi2","formula_anonymous":"AB2C3","energy_above_hull":0.9071197416666668,"spacegroup":164},{"id":"jvasp-40478","created_at":"2022-09-04T14:37:49.149558Z","updated_at":"2022-09-04T14:37:49.149572Z","structure_string":"Li6 Cu2 S4\n1.0\n3.294802 1.902254 5.150118\n-3.294802 1.902254 5.150118\n0.000000 -3.804508 5.150118\nLi Cu S\n6 2 4\ndirect\n0.250000 0.974642 0.525358 Li\n0.025357 0.474643 0.750001 Li\n0.474643 0.750000 0.025358 Li\n0.525357 0.250000 0.974644 Li\n0.974642 0.525357 0.250001 Li\n0.750000 0.025357 0.474644 Li\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.500001 Cu\n0.361779 0.361779 0.361779 S\n0.638221 0.638221 0.638223 S\n0.138221 0.138221 0.138222 S\n0.861778 0.861778 0.861781 S\n","nsites":12,"nelements":3,"elements":["Li","Cu","S"],"chemical_system":"Cu-Li-S","density":2.546457106577534,"density_atomic":0.06196051073910958,"volume":193.67174119217805,"volume_molar":9.719320722446556,"formula_full":"Li6 Cu2 S4","formula_reduced":"Li3CuS2","formula_anonymous":"AB2C3","energy_above_hull":0.8234400750000002,"spacegroup":167},{"id":"jvasp-9581","created_at":"2022-09-04T14:37:34.765951Z","updated_at":"2022-09-04T14:37:34.765969Z","structure_string":"Li4 Zr2 O6\n1.0\n5.172611 -0.035967 -1.027734\n-2.761050 4.374220 -1.027734\n0.035058 0.063068 5.409547\nLi Zr O\n4 2 6\ndirect\n0.741243 0.258756 0.250001 Li\n0.258757 0.741243 0.750001 Li\n0.425166 0.574833 0.250001 Li\n0.574834 0.425166 0.750001 Li\n0.091463 0.908537 0.250001 Zr\n0.908536 0.091463 0.750001 Zr\n0.000000 0.500000 0.000000 O\n0.691411 0.843526 0.988632 O\n0.843526 0.691411 0.488632 O\n0.308589 0.156474 0.011370 O\n0.156474 0.308589 0.511370 O\n0.500000 -0.000000 0.500001 O\n","nsites":12,"nelements":3,"elements":["Li","Zr","O"],"chemical_system":"Li-O-Zr","density":4.149662746568092,"density_atomic":0.09793272754763312,"volume":122.5330928740177,"volume_molar":6.1492627753790625,"formula_full":"Li4 Zr2 O6","formula_reduced":"Li2ZrO3","formula_anonymous":"AB2C3","energy_above_hull":1.8958475000000004,"spacegroup":15},{"id":"jvasp-23462","created_at":"2022-09-04T14:37:40.071877Z","updated_at":"2022-09-04T14:37:40.071904Z","structure_string":"Li8 B4 Pd12\n1.0\n6.810537 -0.000000 -0.000000\n0.000000 6.810537 -0.000000\n0.000000 0.000000 6.810537\nLi B Pd\n8 4 12\ndirect\n0.303766 0.303766 0.303766 Li\n0.053765 0.446235 0.553766 Li\n0.553766 0.053765 0.446235 Li\n0.446235 0.553766 0.053765 Li\n0.196235 0.696235 0.803766 Li\n0.946235 0.946235 0.946235 Li\n0.803766 0.196235 0.696235 Li\n0.696235 0.803766 0.196235 Li\n0.625000 0.625000 0.625000 B\n0.125000 0.875000 0.375000 B\n0.875000 0.375000 0.125000 B\n0.375000 0.125000 0.875000 B\n0.125000 0.306750 0.943251 Pd\n0.193251 0.056750 0.625000 Pd\n0.443251 0.375000 0.693251 Pd\n0.056750 0.625000 0.193251 Pd\n0.943251 0.125000 0.306750 Pd\n0.306750 0.943251 0.125000 Pd\n0.693251 0.443251 0.375000 Pd\n0.556750 0.875000 0.806750 Pd\n0.625000 0.193251 0.056750 Pd\n0.375000 0.693251 0.443251 Pd\n0.875000 0.806750 0.556750 Pd\n0.806750 0.556750 0.875000 Pd\n","nsites":24,"nelements":3,"elements":["Li","B","Pd"],"chemical_system":"B-Li-Pd","density":7.232094969045493,"density_atomic":0.07597438122359279,"volume":315.8959587886335,"volume_molar":7.926541372251293,"formula_full":"Li8 B4 Pd12","formula_reduced":"Li2BPd3","formula_anonymous":"AB2C3","energy_above_hull":1.931986613888889,"spacegroup":212},{"id":"jvasp-55265","created_at":"2022-09-04T14:37:55.780886Z","updated_at":"2022-09-04T14:37:55.780913Z","structure_string":"K4 Ag12 S8\n1.0\n8.010304 -0.000000 4.624752\n2.670101 7.552187 4.624752\n-0.000000 -0.000000 9.249502\nK Ag S\n4 12 8\ndirect\n0.500000 0.000000 0.500000 K\n0.500000 0.500000 0.500000 K\n0.500000 0.500000 -0.000000 K\n-0.000000 0.500000 0.500000 K\n0.711949 0.711949 0.038051 Ag\n0.038051 0.711949 0.711949 Ag\n0.038051 0.711949 0.038051 Ag\n0.711949 0.038051 0.711949 Ag\n0.961949 0.288051 0.961949 Ag\n0.961948 0.961949 0.288051 Ag\n0.288051 0.288051 0.961949 Ag\n0.288050 0.961949 0.288051 Ag\n0.711949 0.038051 0.038051 Ag\n0.288050 0.961949 0.961949 Ag\n0.038051 0.038051 0.711949 Ag\n0.961949 0.288051 0.288051 Ag\n0.744040 0.267880 0.744040 S\n0.744039 0.744040 0.744040 S\n0.255960 0.255960 0.732120 S\n0.267880 0.744040 0.744040 S\n0.732120 0.255960 0.255960 S\n0.255960 0.732120 0.255960 S\n0.255960 0.255960 0.255960 S\n0.744039 0.744040 0.267880 S\n","nsites":24,"nelements":3,"elements":["K","Ag","S"],"chemical_system":"Ag-K-S","density":5.066719851241112,"density_atomic":0.04289149240305239,"volume":559.5515253811039,"volume_molar":14.040408534657168,"formula_full":"K4 Ag12 S8","formula_reduced":"KAg3S2","formula_anonymous":"AB2C3","energy_above_hull":0.3052316300000001,"spacegroup":227},{"id":"jvasp-22215","created_at":"2022-09-04T14:37:37.663311Z","updated_at":"2022-09-04T14:37:37.663336Z","structure_string":"Li4 U2 S6\n1.0\n6.386135 0.026534 -1.105293\n-1.735437 5.452582 -3.297161\n0.000882 0.002511 6.604064\nLi U S\n4 2 6\ndirect\n0.000000 0.000000 0.000000 Li\n0.499999 0.499999 0.499999 Li\n0.499999 0.836280 0.163719 Li\n0.499999 0.163719 0.836280 Li\n-0.000001 0.666693 0.333307 U\n-0.000000 0.333307 0.666692 U\n0.252253 0.746907 0.746906 S\n0.749484 0.916299 0.579245 S\n0.749484 0.579244 0.916299 S\n0.747745 0.253092 0.253093 S\n0.250514 0.083700 0.420754 S\n0.250514 0.420754 0.083700 S\n","nsites":12,"nelements":3,"elements":["Li","U","S"],"chemical_system":"Li-S-U","density":5.019336413246115,"density_atomic":0.05209992053189932,"volume":230.32664690251758,"volume_molar":11.558829070214824,"formula_full":"Li4 U2 S6","formula_reduced":"Li2US3","formula_anonymous":"AB2C3","energy_above_hull":2.167006,"spacegroup":12},{"id":"jvasp-20981","created_at":"2022-09-04T14:37:40.109107Z","updated_at":"2022-09-04T14:37:40.109123Z","structure_string":"Er8 Si12 Rh4\n1.0\n4.080850 -7.068239 0.000000\n4.080850 7.068239 0.000000\n0.000000 0.000000 7.786019\nEr Si Rh\n8 12 4\ndirect\n0.508822 0.491178 0.250000 Er\n0.508822 0.017643 0.250000 Er\n0.017643 0.508822 0.750000 Er\n0.491178 0.508822 0.750000 Er\n0.491178 0.982357 0.750000 Er\n0.982357 0.491178 0.250000 Er\n0.000000 0.000000 0.750000 Er\n0.000000 0.000000 0.250000 Er\n0.166925 0.333850 0.000440 Si\n0.833075 0.666150 0.500440 Si\n0.833075 0.166925 0.500440 Si\n0.166925 0.833075 0.000440 Si\n0.666150 0.833075 0.000440 Si\n0.333850 0.166925 0.999560 Si\n0.833075 0.166925 0.999560 Si\n0.333850 0.166925 0.500440 Si\n0.166925 0.833075 0.499560 Si\n0.666150 0.833075 0.499560 Si\n0.166925 0.333850 0.499560 Si\n0.833075 0.666150 0.999560 Si\n0.666667 0.333333 0.533588 Rh\n0.333333 0.666667 0.033588 Rh\n0.666667 0.333333 0.966412 Rh\n0.333333 0.666667 0.466412 Rh\n","nsites":24,"nelements":3,"elements":["Er","Si","Rh"],"chemical_system":"Er-Rh-Si","density":7.71446767274597,"density_atomic":0.05343230742577895,"volume":449.16645296177046,"volume_molar":11.270598351690419,"formula_full":"Er8 Si12 Rh4","formula_reduced":"Er2Si3Rh","formula_anonymous":"AB2C3","energy_above_hull":2.6293314666666667,"spacegroup":194},{"id":"jvasp-35935","created_at":"2022-09-04T14:37:38.333161Z","updated_at":"2022-09-04T14:37:38.333169Z","structure_string":"Li3 Sm1 Bi2\n1.0\n2.332721 -4.040391 -0.000000\n2.332721 4.040391 0.000000\n0.000000 -0.000000 7.383799\nLi Sm Bi\n3 1 2\ndirect\n0.666667 0.333333 0.649717 Li\n0.333333 0.666667 0.350284 Li\n0.000000 0.000000 0.500000 Li\n0.000000 0.000000 0.000000 Sm\n0.666667 0.333333 0.251523 Bi\n0.333333 0.666667 0.748477 Bi\n","nsites":6,"nelements":3,"elements":["Li","Sm","Bi"],"chemical_system":"Bi-Li-Sm","density":7.028689420847123,"density_atomic":0.04310773403568889,"volume":139.18616077181417,"volume_molar":13.96997753353092,"formula_full":"Li3 Sm1 Bi2","formula_reduced":"Li3SmBi2","formula_anonymous":"AB2C3","energy_above_hull":0.8794062458333332,"spacegroup":164},{"id":"jvasp-35928","created_at":"2022-09-04T14:37:39.466090Z","updated_at":"2022-09-04T14:37:39.466110Z","structure_string":"Li3 Dy1 Sb2\n1.0\n2.260277 -3.914915 0.000000\n2.260277 3.914915 -0.000000\n0.000000 0.000000 7.145292\nLi Dy Sb\n3 1 2\ndirect\n0.333334 0.666667 0.649366 Li\n0.666667 0.333334 0.350633 Li\n0.000000 0.000000 0.500000 Li\n0.000000 0.000000 0.000000 Dy\n0.333334 0.666667 0.248713 Sb\n0.666667 0.333334 0.751287 Sb\n","nsites":6,"nelements":3,"elements":["Li","Dy","Sb"],"chemical_system":"Dy-Li-Sb","density":5.605098914157134,"density_atomic":0.04744793000673641,"volume":126.45441011121352,"volume_molar":12.69210429020825,"formula_full":"Li3 Dy1 Sb2","formula_reduced":"Li3DySb2","formula_anonymous":"AB2C3","energy_above_hull":1.0972881166666668,"spacegroup":164},{"id":"jvasp-5326","created_at":"2022-09-04T14:37:38.199191Z","updated_at":"2022-09-04T14:37:38.199232Z","structure_string":"Sc4 Co6 Si2\n1.0\n2.505130 -4.339013 0.000000\n2.505130 4.339013 0.000000\n0.000000 0.000000 7.464872\nSc Co Si\n4 6 2\ndirect\n0.333333 0.666667 0.438587 Sc\n0.666667 0.333333 0.561412 Sc\n0.666667 0.333333 0.938587 Sc\n0.333333 0.666667 0.061413 Sc\n0.828506 0.657012 0.250000 Co\n0.657012 0.828506 0.750000 Co\n0.171494 0.342987 0.750000 Co\n0.828506 0.171494 0.250000 Co\n0.171494 0.828506 0.750000 Co\n0.342987 0.171494 0.250000 Co\n0.000000 0.000000 0.500000 Si\n0.000000 0.000000 0.000000 Si\n","nsites":12,"nelements":3,"elements":["Sc","Co","Si"],"chemical_system":"Co-Sc-Si","density":6.03293211612214,"density_atomic":0.07394480464793637,"volume":162.28320646912266,"volume_molar":8.144102602843327,"formula_full":"Sc4 Co6 Si2","formula_reduced":"Sc2Co3Si","formula_anonymous":"AB2C3","energy_above_hull":3.259408633333333,"spacegroup":194},{"id":"jvasp-12744","created_at":"2022-09-04T14:37:57.062779Z","updated_at":"2022-09-04T14:37:57.062799Z","structure_string":"Li2 H6 O4\n1.0\n3.061019 -0.000558 -0.727157\n-1.445877 5.311982 -0.635798\n0.020664 -0.001311 5.541798\nLi H O\n2 6 4\ndirect\n0.499999 0.347682 0.652318 Li\n0.499999 0.652318 0.347681 Li\n0.856293 0.018085 0.753711 H\n0.143705 0.246289 0.981915 H\n0.143705 0.981914 0.246288 H\n0.312632 0.735815 0.735814 H\n0.687366 0.264185 0.264185 H\n0.856293 0.753710 0.018085 H\n0.604505 0.715255 0.715255 O\n0.395493 0.284745 0.284744 O\n-0.000001 0.792499 0.207500 O\n-0.000001 0.207501 0.792499 O\n","nsites":12,"nelements":3,"elements":["Li","H","O"],"chemical_system":"H-Li-O","density":1.545377653420933,"density_atomic":0.13306499905597477,"volume":90.18149088891596,"volume_molar":4.525713600664246,"formula_full":"Li2 H6 O4","formula_reduced":"LiH3O2","formula_anonymous":"AB2C3","energy_above_hull":2.2221645000000003,"spacegroup":12}]}