{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=density_atomic&page=121","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=density_atomic&page=119","results":[{"id":"jvasp-64175","created_at":"2022-09-04T14:36:17.118374Z","updated_at":"2022-09-04T14:36:17.118394Z","structure_string":"Ba4 Ta1 Br1\n1.0\n-0.000000 5.030101 5.030101\n5.030101 0.000000 5.030101\n5.030101 5.030101 0.000000\nBa Ta Br\n4 1 1\ndirect\n0.123282 0.625573 0.625573 Ba\n0.625573 0.625573 0.625573 Ba\n0.625573 0.123282 0.625573 Ba\n0.625573 0.625573 0.123282 Ba\n0.000000 0.000000 0.000000 Ta\n0.250000 0.250000 0.250000 Br\n","nsites":6,"nelements":3,"elements":["Ba","Ta","Br"],"chemical_system":"Ba-Br-Ta","density":5.285179213647066,"density_atomic":0.02357171266793008,"volume":254.54238665326827,"volume_molar":25.54816803020545,"formula_full":"Ba4 Ta1 Br1","formula_reduced":"Ba4TaBr","formula_anonymous":"ABC4","energy_above_hull":1.1729611974999996,"spacegroup":216},{"id":"jvasp-5461","created_at":"2022-09-04T14:38:10.624996Z","updated_at":"2022-09-04T14:38:10.625013Z","structure_string":"Al2 Sb2 I12\n1.0\n6.896856 0.057715 2.377134\n2.925097 9.655246 1.807437\n0.096631 -0.023674 10.248752\nAl Sb I\n2 2 12\ndirect\n0.374415 0.795783 0.795782 Al\n0.625585 0.204218 0.204217 Al\n-0.000000 0.200494 0.799506 Sb\n0.000000 0.799507 0.200494 Sb\n0.066792 0.783285 0.454439 I\n0.933209 0.545561 0.216715 I\n0.933209 0.216715 0.545561 I\n0.066791 0.454439 0.783285 I\n0.533809 0.971638 0.290618 I\n0.466192 0.709382 0.028362 I\n0.466192 0.028362 0.709382 I\n0.533808 0.290618 0.971638 I\n0.018591 0.145055 0.145055 I\n0.981410 0.854945 0.854944 I\n0.442079 0.380140 0.380140 I\n0.557922 0.619860 0.619859 I\n","nsites":16,"nelements":3,"elements":["Al","Sb","I"],"chemical_system":"Al-I-Sb","density":4.453946933751461,"density_atomic":0.023575678172902726,"volume":678.6655248114977,"volume_molar":25.5438707460882,"formula_full":"Al2 Sb2 I12","formula_reduced":"AlSbI6","formula_anonymous":"ABC6","energy_above_hull":0.13751081875,"spacegroup":12},{"id":"jvasp-108852","created_at":"2022-09-04T14:38:20.605967Z","updated_at":"2022-09-04T14:38:20.605984Z","structure_string":"K2 Tl1 Au1 I6\n1.0\n7.303673 -0.000000 4.216778\n2.434558 6.885969 4.216778\n-0.000000 -0.000000 8.433555\nK Tl Au I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750001 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500001 Au\n0.740549 0.259451 0.259451 I\n0.259451 0.259451 0.740550 I\n0.259451 0.740549 0.740550 I\n0.259451 0.740549 0.259451 I\n0.740549 0.259451 0.740550 I\n0.740549 0.740549 0.259451 I\n","nsites":10,"nelements":4,"elements":["K","Tl","Au","I"],"chemical_system":"Au-I-K-Tl","density":4.85841339726925,"density_atomic":0.02357669550028178,"volume":424.14765037282194,"volume_molar":25.542768535684,"formula_full":"K2 Tl1 Au1 I6","formula_reduced":"K2TlAuI6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-100946","created_at":"2022-09-04T14:36:36.207728Z","updated_at":"2022-09-04T14:36:36.207746Z","structure_string":"Yb1 Ac3\n1.0\n5.535710 0.000000 0.000000\n0.000000 5.535710 0.000000\n0.000000 0.000000 5.535710\nYb Ac\n1 3\ndirect\n0.000000 0.000000 0.000000 Yb\n-0.000000 0.500000 0.500000 Ac\n0.500000 0.000000 0.500000 Ac\n0.500000 0.500000 -0.000000 Ac\n","nsites":4,"nelements":2,"elements":["Yb","Ac"],"chemical_system":"Ac-Yb","density":8.360020021553764,"density_atomic":0.02357979361323274,"volume":169.6367689051884,"volume_molar":25.539412510465894,"formula_full":"Yb1 Ac3","formula_reduced":"Ac3Yb","formula_anonymous":"AB3","energy_above_hull":0.360225175,"spacegroup":221},{"id":"jvasp-66321","created_at":"2022-09-04T14:36:20.522369Z","updated_at":"2022-09-04T14:36:20.522406Z","structure_string":"Ba1 Ca1 Ti1\n1.0\n0.000000 3.991805 3.991805\n3.991805 0.000000 3.991805\n3.991805 3.991805 -0.000000\nBa Ca Ti\n1 1 1\ndirect\n0.750001 0.750001 0.750001 Ba\n0.000000 0.000000 0.000000 Ca\n0.500001 0.500001 0.500001 Ti\n","nsites":3,"nelements":3,"elements":["Ba","Ca","Ti"],"chemical_system":"Ba-Ca-Ti","density":2.9404809026416276,"density_atomic":0.023582145012144305,"volume":127.21489069187996,"volume_molar":25.536865950483833,"formula_full":"Ba1 Ca1 Ti1","formula_reduced":"BaCaTi","formula_anonymous":"ABC","energy_above_hull":1.3363949077777777,"spacegroup":216},{"id":"jvasp-64578","created_at":"2022-09-04T14:36:20.281163Z","updated_at":"2022-09-04T14:36:20.281195Z","structure_string":"Ba4 Y1 P1\n1.0\n0.000000 5.029273 5.029273\n5.029273 0.000000 5.029273\n5.029273 5.029273 0.000000\nBa Y P\n4 1 1\ndirect\n0.129164 0.623612 0.623612 Ba\n0.623612 0.623612 0.623612 Ba\n0.623612 0.129164 0.623612 Ba\n0.623612 0.623612 0.129164 Ba\n0.000000 0.000000 0.000000 Y\n0.250000 0.250000 0.250000 P\n","nsites":6,"nelements":3,"elements":["Ba","Y","P"],"chemical_system":"Ba-P-Y","density":4.367685533941592,"density_atomic":0.023583356850815453,"volume":254.4167074244367,"volume_molar":25.535553730094914,"formula_full":"Ba4 Y1 P1","formula_reduced":"Ba4YP","formula_anonymous":"ABC4","energy_above_hull":0.9936241383333332,"spacegroup":216},{"id":"jvasp-66051","created_at":"2022-09-04T14:35:40.770361Z","updated_at":"2022-09-04T14:35:40.770371Z","structure_string":"Ba1 Ca1 Se1\n1.0\n0.000000 3.991685 3.991685\n3.991685 0.000000 3.991685\n3.991685 3.991685 0.000000\nBa Ca Se\n1 1 1\ndirect\n0.749999 0.749999 0.749999 Ba\n0.000000 0.000000 0.000000 Ca\n0.499999 0.499999 0.499999 Se\n","nsites":3,"nelements":3,"elements":["Ba","Ca","Se"],"chemical_system":"Ba-Ca-Se","density":3.346640395839391,"density_atomic":0.023584271890248323,"volume":127.20341819161467,"volume_molar":25.53456298343494,"formula_full":"Ba1 Ca1 Se1","formula_reduced":"BaCaSe","formula_anonymous":"ABC","energy_above_hull":0.0786065855555555,"spacegroup":216},{"id":"jvasp-66214","created_at":"2022-09-04T14:35:52.219932Z","updated_at":"2022-09-04T14:35:52.219951Z","structure_string":"Ba1 Sn1 Bi1\n1.0\n-0.000000 3.991673 3.991673\n3.991673 -0.000000 3.991673\n3.991673 3.991673 -0.000000\nBa Sn Bi\n1 1 1\ndirect\n0.749999 0.749999 0.749999 Ba\n0.500000 0.500000 0.500000 Sn\n0.000000 0.000000 0.000000 Bi\n","nsites":3,"nelements":3,"elements":["Ba","Sn","Bi"],"chemical_system":"Ba-Bi-Sn","density":6.07048563993837,"density_atomic":0.023584484592125567,"volume":127.20227097952548,"volume_molar":25.534332694345515,"formula_full":"Ba1 Sn1 Bi1","formula_reduced":"BaSnBi","formula_anonymous":"ABC","energy_above_hull":0.2678973233333332,"spacegroup":216},{"id":"jvasp-66148","created_at":"2022-09-04T14:36:03.746243Z","updated_at":"2022-09-04T14:36:03.746276Z","structure_string":"Ba1 Mg1 Cd1\n1.0\n0.000000 3.991592 3.991592\n3.991592 0.000000 3.991592\n3.991592 3.991592 -0.000000\nBa Mg Cd\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Cd\n","nsites":3,"nelements":3,"elements":["Ba","Mg","Cd"],"chemical_system":"Ba-Cd-Mg","density":3.5776626278655237,"density_atomic":0.02358592039670041,"volume":127.19452747833787,"volume_molar":25.53277827920795,"formula_full":"Ba1 Mg1 Cd1","formula_reduced":"BaMgCd","formula_anonymous":"ABC","energy_above_hull":0.0,"spacegroup":216},{"id":"jvasp-115194","created_at":"2022-09-04T14:38:44.416063Z","updated_at":"2022-09-04T14:38:44.416084Z","structure_string":"Li1 I2\n1.0\n4.429972 0.000000 0.107131\n0.000000 4.378913 0.000000\n-0.144500 0.000000 6.553364\nLi I\n1 2\ndirect\n0.466710 0.000000 0.133352 Li\n-0.032938 0.000000 -0.121201 I\n-0.033771 0.000000 0.387849 I\n","nsites":3,"nelements":2,"elements":["Li","I"],"chemical_system":"I-Li","density":3.404161900517162,"density_atomic":0.023586209233829102,"volume":127.19296985194111,"volume_molar":25.532465604360862,"formula_full":"Li1 I2","formula_reduced":"LiI2","formula_anonymous":"AB2","energy_above_hull":0.1481020916666668,"spacegroup":47},{"id":"jvasp-64466","created_at":"2022-09-04T14:36:04.268517Z","updated_at":"2022-09-04T14:36:04.268543Z","structure_string":"K1 Ba1 Mo1\n1.0\n0.000000 3.991542 3.991542\n3.991542 -0.000000 3.991542\n3.991542 3.991542 -0.000000\nK Ba Mo\n1 1 1\ndirect\n0.000000 0.000000 0.000000 K\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Mo\n","nsites":3,"nelements":3,"elements":["K","Ba","Mo"],"chemical_system":"Ba-K-Mo","density":3.555893688196458,"density_atomic":0.02358680675399716,"volume":127.18974769620318,"volume_molar":25.531818795180712,"formula_full":"K1 Ba1 Mo1","formula_reduced":"KBaMo","formula_anonymous":"ABC","energy_above_hull":1.98714329,"spacegroup":216},{"id":"jvasp-64463","created_at":"2022-09-04T14:35:58.384711Z","updated_at":"2022-09-04T14:35:58.384738Z","structure_string":"Ba4 In1 Ga1\n1.0\n0.000000 5.028841 5.028841\n5.028841 -0.000000 5.028841\n5.028841 5.028841 -0.000000\nBa In Ga\n4 1 1\ndirect\n0.125024 0.624992 0.624992 Ba\n0.624992 0.624992 0.624992 Ba\n0.624992 0.125024 0.624992 Ba\n0.624992 0.624992 0.125024 Ba\n0.000000 0.000000 0.000000 In\n0.250000 0.250000 0.250000 Ga\n","nsites":6,"nelements":3,"elements":["Ba","In","Ga"],"chemical_system":"Ba-Ga-In","density":4.790955038053928,"density_atomic":0.02358943512136351,"volume":254.35115207850683,"volume_molar":25.528974004748914,"formula_full":"Ba4 In1 Ga1","formula_reduced":"Ba4InGa","formula_anonymous":"ABC4","energy_above_hull":0.0,"spacegroup":216}]}