{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=id&page=608","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=id&page=606","results":[{"id":"jvasp-110346","created_at":"2022-09-04T14:38:39.000007Z","updated_at":"2022-09-04T14:38:39.000031Z","structure_string":"K2 Tl1 As1 Cl6\n1.0\n6.650644 -0.000000 3.839751\n2.216882 6.270287 3.839751\n0.000000 0.000000 7.679502\nK Tl As Cl\n2 1 1 6\ndirect\n0.749999 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 As\n0.769725 0.230274 0.230274 Cl\n0.230274 0.230274 0.769726 Cl\n0.230274 0.769726 0.769726 Cl\n0.230274 0.769726 0.230274 Cl\n0.769725 0.230274 0.769726 Cl\n0.769725 0.769726 0.230274 Cl\n","nsites":10,"nelements":4,"elements":["K","Tl","As","Cl"],"chemical_system":"As-Cl-K-Tl","density":2.9566981104572085,"density_atomic":0.0312259616027733,"volume":320.2463426814648,"volume_molar":19.285685535029767,"formula_full":"K2 Tl1 As1 Cl6","formula_reduced":"K2TlAsCl6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-110348","created_at":"2022-09-04T14:38:39.235143Z","updated_at":"2022-09-04T14:38:39.235172Z","structure_string":"K2 Li1 Mo1 Cl6\n1.0\n6.059880 -0.000000 3.498673\n2.019960 5.713309 3.498673\n0.000000 0.000000 6.997346\nK Li Mo 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 Li\n0.000000 0.000000 0.000000 Mo\n0.753055 0.246945 0.246945 Cl\n0.246945 0.246945 0.753055 Cl\n0.246945 0.753055 0.753054 Cl\n0.246945 0.753055 0.246945 Cl\n0.753055 0.246945 0.753054 Cl\n0.753055 0.753055 0.246945 Cl\n","nsites":10,"nelements":4,"elements":["K","Li","Mo","Cl"],"chemical_system":"Cl-K-Li-Mo","density":2.6991987882131556,"density_atomic":0.04127764517292326,"volume":242.26188190017348,"volume_molar":14.589351535853408,"formula_full":"K2 Li1 Mo1 Cl6","formula_reduced":"K2LiMoCl6","formula_anonymous":"ABC2D6","energy_above_hull":0.4910096304999999,"spacegroup":225},{"id":"jvasp-110349","created_at":"2022-09-04T14:38:39.273347Z","updated_at":"2022-09-04T14:38:39.273380Z","structure_string":"Rb2 Hg1 Sb1 F6\n1.0\n5.825235 -0.000000 3.363201\n1.941745 5.492084 3.363201\n0.000000 0.000000 6.726401\nRb Hg Sb F\n2 1 1 6\ndirect\n0.749999 0.749999 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.499999 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Sb\n0.776049 0.223950 0.223950 F\n0.223950 0.223950 0.776050 F\n0.223949 0.776049 0.776050 F\n0.223949 0.776049 0.223951 F\n0.776049 0.223950 0.776050 F\n0.776049 0.776049 0.223951 F\n","nsites":10,"nelements":4,"elements":["Rb","Hg","Sb","F"],"chemical_system":"F-Hg-Rb-Sb","density":4.685995348495624,"density_atomic":0.046469352826204985,"volume":215.19559433934708,"volume_molar":12.959381600434074,"formula_full":"Rb2 Hg1 Sb1 F6","formula_reduced":"Rb2HgSbF6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-11035","created_at":"2022-09-04T14:37:18.761110Z","updated_at":"2022-09-04T14:37:18.761129Z","structure_string":"Mg2 Fe4 O8\n1.0\n2.758631 -0.000069 0.565818\n1.168672 7.695544 1.309991\n-0.027254 1.104055 7.139453\nMg Fe O\n2 4 8\ndirect\n0.330031 0.144131 0.195904 Mg\n0.665419 0.832916 0.836336 Mg\n0.589875 0.199266 0.621088 Fe\n0.157661 0.477895 0.206898 Fe\n0.837816 0.499153 0.825329 Fe\n0.405599 0.777780 0.411144 Fe\n0.844440 0.701353 0.609932 O\n0.434270 0.378898 0.752658 O\n0.561206 0.598150 0.279568 O\n0.151031 0.275695 0.422300 O\n0.110277 0.021040 0.758520 O\n0.781699 0.343464 0.093232 O\n0.885186 0.956006 0.273709 O\n0.213770 0.633583 0.939000 O\n","nsites":14,"nelements":3,"elements":["Mg","Fe","O"],"chemical_system":"Fe-Mg-O","density":4.474953211159172,"density_atomic":0.09432428349313536,"volume":148.42413301786573,"volume_molar":6.384507294389649,"formula_full":"Mg2 Fe4 O8","formula_reduced":"Mg(FeO2)2","formula_anonymous":"AB2C4","energy_above_hull":2.3015634357142853,"spacegroup":12},{"id":"jvasp-110352","created_at":"2022-09-04T14:38:39.154758Z","updated_at":"2022-09-04T14:38:39.154780Z","structure_string":"K2 In1 Sb1 Cl6\n1.0\n6.783217 -0.000000 3.916292\n2.261073 6.395279 3.916292\n0.000000 0.000000 7.832585\nK In Sb Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.499999 In\n0.000000 0.000000 0.000000 Sb\n0.760012 0.239988 0.239988 Cl\n0.239988 0.239988 0.760011 Cl\n0.239988 0.760012 0.760011 Cl\n0.239988 0.760012 0.239988 Cl\n0.760012 0.239988 0.760011 Cl\n0.760012 0.760012 0.239988 Cl\n","nsites":10,"nelements":4,"elements":["K","In","Sb","Cl"],"chemical_system":"Cl-In-K-Sb","density":2.5778945355414087,"density_atomic":0.02943063800862818,"volume":339.7819645319378,"volume_molar":20.46214818120656,"formula_full":"K2 In1 Sb1 Cl6","formula_reduced":"K2InSbCl6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-110353","created_at":"2022-09-04T14:38:38.503813Z","updated_at":"2022-09-04T14:38:38.503845Z","structure_string":"K2 Sb1 Au1 Cl6\n1.0\n6.485572 -0.000000 3.744447\n2.161858 6.114656 3.744447\n0.000000 0.000000 7.488894\nK Sb Au Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Sb\n0.500000 0.500000 0.500000 Au\n0.749928 0.250072 0.250072 Cl\n0.250072 0.250072 0.749928 Cl\n0.250072 0.749929 0.749928 Cl\n0.250072 0.749929 0.250072 Cl\n0.749928 0.250072 0.749928 Cl\n0.749928 0.749929 0.250072 Cl\n","nsites":10,"nelements":4,"elements":["K","Sb","Au","Cl"],"chemical_system":"Au-Cl-K-Sb","density":3.408673361884074,"density_atomic":0.033671464200643875,"volume":296.9873819686397,"volume_molar":17.88499818159034,"formula_full":"K2 Sb1 Au1 Cl6","formula_reduced":"K2SbAuCl6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-110354","created_at":"2022-09-04T14:38:37.278079Z","updated_at":"2022-09-04T14:38:37.278101Z","structure_string":"K2 Tl1 Ag1 I6\n1.0\n7.284119 -0.000000 4.205488\n2.428040 6.867533 4.205488\n-0.000000 -0.000000 8.410976\nK Tl Ag 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 0.500000 Ag\n0.743151 0.256849 0.256850 I\n0.256849 0.256849 0.743151 I\n0.256850 0.743150 0.743151 I\n0.256850 0.743150 0.256850 I\n0.743151 0.256849 0.743151 I\n0.743151 0.743150 0.256850 I\n","nsites":10,"nelements":4,"elements":["K","Tl","Ag","I"],"chemical_system":"Ag-I-K-Tl","density":4.546008452897118,"density_atomic":0.023767079509776183,"volume":420.75005454021687,"volume_molar":25.338160532188628,"formula_full":"K2 Tl1 Ag1 I6","formula_reduced":"K2TlAgI6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-110356","created_at":"2022-09-04T14:38:38.145062Z","updated_at":"2022-09-04T14:38:38.145083Z","structure_string":"K2 Ag1 Bi1 I6\n1.0\n7.359959 -0.000000 4.249274\n2.453320 6.939036 4.249274\n0.000000 0.000000 8.498549\nK Ag Bi I\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.499999 Ag\n0.000000 0.000000 0.000000 Bi\n0.745109 0.254891 0.254891 I\n0.254891 0.254891 0.745109 I\n0.254891 0.745109 0.745108 I\n0.254891 0.745109 0.254891 I\n0.745109 0.254891 0.745108 I\n0.745109 0.745109 0.254890 I\n","nsites":10,"nelements":4,"elements":["K","Ag","Bi","I"],"chemical_system":"Ag-Bi-I-K","density":4.424507227192349,"density_atomic":0.023039904869464604,"volume":434.02956985526725,"volume_molar":26.137871636706723,"formula_full":"K2 Ag1 Bi1 I6","formula_reduced":"K2AgBiI6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-110357","created_at":"2022-09-04T14:38:38.617021Z","updated_at":"2022-09-04T14:38:38.617050Z","structure_string":"K1 Au1 F3\n1.0\n4.439236 -0.000000 -0.000000\n0.000000 4.439236 -0.000000\n0.000000 0.000000 4.439236\nK Au F\n1 1 3\ndirect\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Au\n0.500000 0.000000 0.000000 F\n0.000000 0.000000 0.500000 F\n0.000000 0.500000 0.000000 F\n","nsites":5,"nelements":3,"elements":["K","Au","F"],"chemical_system":"Au-F-K","density":5.562641327075277,"density_atomic":0.05715382531910824,"volume":87.48320820318479,"volume_molar":10.53672387871931,"formula_full":"K1 Au1 F3","formula_reduced":"KAuF3","formula_anonymous":"ABC3","energy_above_hull":0.0,"spacegroup":221},{"id":"jvasp-110359","created_at":"2022-09-04T14:38:38.274555Z","updated_at":"2022-09-04T14:38:38.274570Z","structure_string":"K2 Tl1 Ag1 F6\n1.0\n5.528553 0.000000 3.191911\n1.842851 5.212370 3.191911\n0.000000 0.000000 6.383824\nK Tl Ag F\n2 1 1 6\ndirect\n0.749999 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Ag\n0.755650 0.244350 0.244350 F\n0.244350 0.244350 0.755650 F\n0.244350 0.755650 0.755650 F\n0.244350 0.755650 0.244350 F\n0.755650 0.244350 0.755650 F\n0.755650 0.755650 0.244350 F\n","nsites":10,"nelements":4,"elements":["K","Tl","Ag","F"],"chemical_system":"Ag-F-K-Tl","density":4.553336226483768,"density_atomic":0.05435911543086725,"volume":183.96178673506532,"volume_molar":11.078437741796641,"formula_full":"K2 Tl1 Ag1 F6","formula_reduced":"K2TlAgF6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-110367","created_at":"2022-09-04T14:38:38.829865Z","updated_at":"2022-09-04T14:38:38.829893Z","structure_string":"Rb2 Al1 Hg1 Cl6\n1.0\n6.361334 0.000000 3.672719\n2.120444 5.997524 3.672719\n-0.000000 -0.000000 7.345436\nRb Al Hg Cl\n2 1 1 6\ndirect\n0.749999 0.749999 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Al\n0.499999 0.500000 0.500001 Hg\n0.774251 0.225748 0.225749 Cl\n0.225748 0.225748 0.774252 Cl\n0.225748 0.774251 0.774253 Cl\n0.225748 0.774251 0.225749 Cl\n0.774251 0.225748 0.774252 Cl\n0.774251 0.774251 0.225750 Cl\n","nsites":10,"nelements":4,"elements":["Rb","Al","Hg","Cl"],"chemical_system":"Al-Cl-Hg-Rb","density":3.6217004978733507,"density_atomic":0.03568307129227195,"volume":280.2449351428375,"volume_molar":16.876744467072385,"formula_full":"Rb2 Al1 Hg1 Cl6","formula_reduced":"Rb2AlHgCl6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-110368","created_at":"2022-09-04T14:38:38.185146Z","updated_at":"2022-09-04T14:38:38.185175Z","structure_string":"Na3 Sc1 Br6\n1.0\n6.622427 0.000000 3.823460\n2.207475 6.243684 3.823460\n0.000000 0.000000 7.646920\nNa Sc Br\n3 1 6\ndirect\n0.750001 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.500001 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Sc\n0.757677 0.242323 0.242323 Br\n0.242324 0.242323 0.757677 Br\n0.242324 0.757676 0.757677 Br\n0.242324 0.757676 0.242323 Br\n0.757677 0.242323 0.757676 Br\n0.757678 0.757676 0.242323 Br\n","nsites":10,"nelements":3,"elements":["Na","Sc","Br"],"chemical_system":"Br-Na-Sc","density":3.116124722196021,"density_atomic":0.03162680775804452,"volume":316.1874595913469,"volume_molar":19.04125388205903,"formula_full":"Na3 Sc1 Br6","formula_reduced":"Na3ScBr6","formula_anonymous":"AB3C6","energy_above_hull":0.015307,"spacegroup":225}]}