{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=energy_above_hull&page=88","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=energy_above_hull&page=86","results":[{"id":"jvasp-63576","created_at":"2022-09-04T14:35:59.092820Z","updated_at":"2022-09-04T14:35:59.092847Z","structure_string":"Na18 As6\n1.0\n4.386619 -7.597847 0.000000\n4.386619 7.597847 0.000000\n-0.000000 -0.000000 8.988453\nNa As\n18 6\ndirect\n0.698551 0.698551 0.414084 Na\n0.000000 0.000000 0.202841 Na\n0.000000 0.000000 0.702841 Na\n0.333333 0.666667 0.767690 Na\n0.666667 0.333333 0.267690 Na\n0.333333 0.666667 0.267690 Na\n0.666667 0.333333 0.767690 Na\n-0.000000 0.638960 0.575581 Na\n0.361040 0.361040 0.575581 Na\n0.638960 -0.000000 0.575581 Na\n-0.000000 0.361040 0.075581 Na\n0.638960 0.638960 0.075581 Na\n0.698551 -0.000000 0.914084 Na\n-0.000000 0.698551 0.914084 Na\n0.301449 0.301449 0.914084 Na\n0.301449 -0.000000 0.414084 Na\n-0.000000 0.301449 0.414084 Na\n0.361040 -0.000000 0.075581 Na\n-0.000000 0.669251 0.244895 As\n0.669251 0.669251 0.744894 As\n-0.000000 0.330749 0.744894 As\n0.330749 -0.000000 0.744894 As\n0.330749 0.330749 0.244895 As\n0.669251 -0.000000 0.244895 As\n","nsites":24,"nelements":2,"elements":["Na","As"],"chemical_system":"As-Na","density":2.3927553381863955,"density_atomic":0.04005676153437631,"volume":599.1497834742192,"volume_molar":15.034018051688626,"formula_full":"Na18 As6","formula_reduced":"Na3As","formula_anonymous":"AB3","energy_above_hull":0.0,"spacegroup":185},{"id":"jvasp-69359","created_at":"2022-09-04T14:35:49.693742Z","updated_at":"2022-09-04T14:35:49.693767Z","structure_string":"Ba1 Na2 Ca1\n1.0\n4.423358 0.000000 0.000000\n-0.000000 4.419967 0.000000\n0.000000 0.000000 8.845214\nBa Na Ca\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.723953 Na\n0.000000 0.000000 0.276047 Na\n0.500000 0.500000 0.500000 Ca\n","nsites":4,"nelements":3,"elements":["Ba","Na","Ca"],"chemical_system":"Ba-Ca-Na","density":2.1449775265939373,"density_atomic":0.023130260813784578,"volume":172.93363149697745,"volume_molar":26.035766775319193,"formula_full":"Ba1 Na2 Ca1","formula_reduced":"BaNa2Ca","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":123},{"id":"jvasp-65156","created_at":"2022-09-04T14:35:58.999955Z","updated_at":"2022-09-04T14:35:58.999970Z","structure_string":"Be1 Cd4 Ni1\n1.0\n0.000000 3.882540 3.882540\n3.882540 -0.000000 3.882540\n3.882540 3.882540 0.000000\nBe Cd Ni\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.125468 0.624844 0.624844 Cd\n0.624844 0.624844 0.624844 Cd\n0.624844 0.125468 0.624844 Cd\n0.624844 0.624844 0.125468 Cd\n0.250000 0.250000 0.250000 Ni\n","nsites":6,"nelements":3,"elements":["Be","Cd","Ni"],"chemical_system":"Be-Cd-Ni","density":7.339312638143152,"density_atomic":0.051259390564833605,"volume":117.05172328202214,"volume_molar":11.748365896748442,"formula_full":"Be1 Cd4 Ni1","formula_reduced":"BeCd4Ni","formula_anonymous":"ABC4","energy_above_hull":0.0,"spacegroup":216},{"id":"jvasp-100078","created_at":"2022-09-04T14:36:46.957532Z","updated_at":"2022-09-04T14:36:46.957550Z","structure_string":"K3 Al1 Br6\n1.0\n6.760486 -0.000000 3.903169\n2.253495 6.373848 3.903169\n-0.000000 -0.000000 7.806337\nK Al Br\n3 1 6\ndirect\n0.750001 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500001 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Al\n0.773488 0.226513 0.226513 Br\n0.226513 0.226513 0.773487 Br\n0.226513 0.773487 0.773487 Br\n0.226513 0.773487 0.226513 Br\n0.773488 0.226513 0.773487 Br\n0.773488 0.773487 0.226513 Br\n","nsites":10,"nelements":3,"elements":["K","Al","Br"],"chemical_system":"Al-Br-K","density":3.078918767321305,"density_atomic":0.029728505969054797,"volume":336.3774826225465,"volume_molar":20.25712548847429,"formula_full":"K3 Al1 Br6","formula_reduced":"K3AlBr6","formula_anonymous":"AB3C6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-99679","created_at":"2022-09-04T14:36:35.119415Z","updated_at":"2022-09-04T14:36:35.119436Z","structure_string":"K2 Rb1 Dy1 Cl6\n1.0\n6.909239 -0.000000 3.989051\n2.303080 6.514092 3.989051\n-0.000000 -0.000000 7.978101\nK Rb Dy Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Dy\n0.768242 0.231758 0.231758 Cl\n0.231758 0.231758 0.768242 Cl\n0.231758 0.768242 0.768242 Cl\n0.231758 0.768242 0.231758 Cl\n0.768242 0.231758 0.768242 Cl\n0.768243 0.768242 0.231758 Cl\n","nsites":10,"nelements":4,"elements":["K","Rb","Dy","Cl"],"chemical_system":"Cl-Dy-K-Rb","density":2.492065560550936,"density_atomic":0.02784943355725171,"volume":359.0737305102603,"volume_molar":21.623925483510938,"formula_full":"K2 Rb1 Dy1 Cl6","formula_reduced":"K2RbDyCl6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-105684","created_at":"2022-09-04T14:35:43.910691Z","updated_at":"2022-09-04T14:35:43.910714Z","structure_string":"Rb2 Na1 Sb1 I6\n1.0\n7.415985 0.000000 4.281621\n2.471995 6.991859 4.281621\n0.000000 0.000000 8.563243\nRb Na Sb I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Sb\n0.751951 0.248049 0.248049 I\n0.248049 0.248049 0.751950 I\n0.248049 0.751951 0.751951 I\n0.248049 0.751951 0.248049 I\n0.751951 0.248049 0.751950 I\n0.751951 0.751951 0.248049 I\n","nsites":10,"nelements":4,"elements":["Rb","Na","Sb","I"],"chemical_system":"I-Na-Rb-Sb","density":4.028192955335747,"density_atomic":0.022521651166227185,"volume":444.01717823405903,"volume_molar":26.73933947183512,"formula_full":"Rb2 Na1 Sb1 I6","formula_reduced":"Rb2NaSbI6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-65656","created_at":"2022-09-04T14:36:02.643803Z","updated_at":"2022-09-04T14:36:02.643823Z","structure_string":"Ba1 Na2 Ga1\n1.0\n4.202624 -0.000000 -0.000000\n-0.000000 4.202624 0.000000\n0.000000 0.000000 7.672023\nBa Na Ga\n1 2 1\ndirect\n0.499999 0.499999 0.000000 Ba\n0.000000 0.000000 0.687585 Na\n0.000000 0.000000 0.312415 Na\n0.499999 0.499999 0.500000 Ga\n","nsites":4,"nelements":3,"elements":["Ba","Na","Ga"],"chemical_system":"Ba-Ga-Na","density":3.100768561933122,"density_atomic":0.02951950172595235,"volume":135.50364220691984,"volume_molar":20.40055017156871,"formula_full":"Ba1 Na2 Ga1","formula_reduced":"BaNa2Ga","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":123},{"id":"jvasp-99613","created_at":"2022-09-04T14:36:21.069891Z","updated_at":"2022-09-04T14:36:21.069901Z","structure_string":"Sr2 Zn3 Cd1\n1.0\n4.677153 0.043537 3.883742\n2.149693 4.154091 3.883742\n0.006207 0.003816 7.834907\nSr Zn Cd\n2 3 1\ndirect\n0.452803 0.452805 0.795465 Sr\n0.546390 0.546391 0.203109 Sr\n0.175845 0.175845 0.389169 Zn\n0.153380 0.153380 0.788869 Zn\n0.835394 0.835396 0.217643 Zn\n0.836185 0.836187 0.605745 Cd\n","nsites":6,"nelements":3,"elements":["Sr","Zn","Cd"],"chemical_system":"Cd-Sr-Zn","density":5.308627194084495,"density_atomic":0.03964135614703116,"volume":151.35708217816244,"volume_molar":15.191560898329696,"formula_full":"Sr2 Zn3 Cd1","formula_reduced":"Sr2Zn3Cd","formula_anonymous":"AB2C3","energy_above_hull":0.0,"spacegroup":8},{"id":"jvasp-90854","created_at":"2022-09-04T14:35:43.386296Z","updated_at":"2022-09-04T14:35:43.386320Z","structure_string":"K1 Cd4 As3\n1.0\n-2.266297 -3.925342 0.000000\n2.266297 -3.925342 0.000000\n-0.000000 -2.616894 12.031292\nK Cd As\n1 4 3\ndirect\n0.500000 0.500000 0.500000 K\n0.089762 0.089762 0.730713 Cd\n0.910237 0.910237 0.269287 Cd\n0.301042 0.301042 0.096873 Cd\n0.698957 0.698957 0.903127 Cd\n0.226460 0.226460 0.320621 As\n0.773540 0.773540 0.679379 As\n0.000000 0.000000 0.000000 As\n","nsites":8,"nelements":3,"elements":["K","Cd","As"],"chemical_system":"As-Cd-K","density":5.534913123847254,"density_atomic":0.03737260743468236,"volume":214.06052585391396,"volume_molar":16.113782723148613,"formula_full":"K1 Cd4 As3","formula_reduced":"KCd4As3","formula_anonymous":"AB3C4","energy_above_hull":0.0,"spacegroup":166},{"id":"jvasp-106133","created_at":"2022-09-04T14:35:49.899552Z","updated_at":"2022-09-04T14:35:49.899578Z","structure_string":"Ba1 In1 Ge1\n1.0\n4.636418 0.000000 0.000000\n-2.318209 4.015256 0.000000\n-0.000000 -0.000000 5.169116\nBa In Ge\n1 1 1\ndirect\n0.000000 0.000000 0.012784 Ba\n0.333333 0.666668 0.561055 In\n0.666667 0.333333 0.426163 Ge\n","nsites":3,"nelements":3,"elements":["Ba","In","Ge"],"chemical_system":"Ba-Ge-In","density":5.604449492437954,"density_atomic":0.03117519319312973,"volume":96.23035794566073,"volume_molar":19.317092031131775,"formula_full":"Ba1 In1 Ge1","formula_reduced":"BaInGe","formula_anonymous":"ABC","energy_above_hull":0.0,"spacegroup":156},{"id":"jvasp-91278","created_at":"2022-09-04T14:35:49.941979Z","updated_at":"2022-09-04T14:35:49.941994Z","structure_string":"Mg1 Pb1 F6\n1.0\n4.638572 0.070780 3.203243\n1.718157 4.309211 3.203243\n0.102724 0.070780 5.636184\nMg Pb F\n1 1 6\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Pb\n0.388870 0.095904 0.759042 F\n0.095904 0.759041 0.388870 F\n0.240958 0.611129 0.904095 F\n0.904095 0.240958 0.611129 F\n0.611129 0.904096 0.240958 F\n0.759042 0.388871 0.095904 F\n","nsites":8,"nelements":3,"elements":["Mg","Pb","F"],"chemical_system":"F-Mg-Pb","density":5.219465028315315,"density_atomic":0.07278210096343773,"volume":109.917134763928,"volume_molar":8.274205718553299,"formula_full":"Mg1 Pb1 F6","formula_reduced":"MgPbF6","formula_anonymous":"ABC6","energy_above_hull":0.0,"spacegroup":148},{"id":"jvasp-57174","created_at":"2022-09-04T14:37:33.806856Z","updated_at":"2022-09-04T14:37:33.806876Z","structure_string":"Na4 Ni4 F12\n1.0\n5.346565 0.000000 0.000000\n0.000000 5.576620 0.000000\n0.000000 0.000000 7.686630\nNa Ni F\n4 4 12\ndirect\n0.018534 0.935800 0.750000 Na\n0.518534 0.564200 0.250000 Na\n0.481467 0.435800 0.750000 Na\n0.981467 0.064200 0.250000 Na\n0.500000 0.000000 0.500000 Ni\n0.000000 0.500000 0.500000 Ni\n0.000000 0.500000 0.000000 Ni\n0.500000 0.000000 0.000000 Ni\n0.610476 0.038486 0.750000 F\n0.110475 0.461514 0.250000 F\n0.692962 0.301950 0.056907 F\n0.192962 0.198050 0.943093 F\n0.807039 0.801950 0.443093 F\n0.192962 0.198050 0.556907 F\n0.307039 0.698050 0.943093 F\n0.807039 0.801950 0.056907 F\n0.389525 0.961514 0.250000 F\n0.692962 0.301950 0.443093 F\n0.307039 0.698050 0.556907 F\n0.889525 0.538486 0.750000 F\n","nsites":20,"nelements":3,"elements":["Na","Ni","F"],"chemical_system":"F-Na-Ni","density":4.019166199558492,"density_atomic":0.08726661212590268,"volume":229.1827253605913,"volume_molar":6.900853159409513,"formula_full":"Na4 Ni4 F12","formula_reduced":"NaNiF3","formula_anonymous":"ABC3","energy_above_hull":0.0,"spacegroup":62}]}