{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_full&page=549","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_full&page=547","results":[{"id":"jvasp-99909","created_at":"2022-09-04T14:36:31.628941Z","updated_at":"2022-09-04T14:36:31.628951Z","structure_string":"Tl1 Bi1 Se2\n1.0\n4.347477 0.000000 0.000000\n-0.000000 4.347477 -0.000000\n0.000000 0.000000 6.094413\nTl Bi Se\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Bi\n0.000000 0.000000 0.500000 Se\n0.500000 0.500000 0.000000 Se\n","nsites":4,"nelements":3,"elements":["Tl","Bi","Se"],"chemical_system":"Bi-Se-Tl","density":8.235585161392823,"density_atomic":0.03472590105407465,"volume":115.18779581187138,"volume_molar":17.3419280053307,"formula_full":"Tl1 Bi1 Se2","formula_reduced":"TlBiSe2","formula_anonymous":"ABC2","energy_above_hull":0.6803434083333333,"spacegroup":123},{"id":"jvasp-108722","created_at":"2022-09-04T14:38:18.787630Z","updated_at":"2022-09-04T14:38:18.787653Z","structure_string":"Tl1 Bi1 S2\n1.0\n4.200624 -0.000000 0.000000\n0.000000 4.200624 0.000000\n-0.000000 -0.000000 5.872788\nTl Bi S\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Bi\n0.000000 0.000000 0.500000 S\n0.500000 0.500000 -0.000000 S\n","nsites":4,"nelements":3,"elements":["Tl","Bi","S"],"chemical_system":"Bi-S-Tl","density":7.651468611904008,"density_atomic":0.03860006615168443,"volume":103.62676541230353,"volume_molar":15.601374195409782,"formula_full":"Tl1 Bi1 S2","formula_reduced":"TlBiS2","formula_anonymous":"ABC2","energy_above_hull":0.932459225,"spacegroup":123},{"id":"jvasp-26523","created_at":"2022-09-04T14:37:54.087286Z","updated_at":"2022-09-04T14:37:54.087304Z","structure_string":"Tl1 Bi1 S2\n1.0\n4.000396 0.003908 6.656450\n1.849284 3.547299 6.656450\n0.006438 0.003908 7.766045\nTl Bi S\n1 1 2\ndirect\n0.500000 0.500001 0.500000 Tl\n0.000000 0.000000 0.000000 Bi\n0.262098 0.262098 0.262098 S\n0.737902 0.737903 0.737901 S\n","nsites":4,"nelements":3,"elements":["Tl","Bi","S"],"chemical_system":"Bi-S-Tl","density":7.2120280918100015,"density_atomic":0.03638318021700655,"volume":109.94091160096787,"volume_molar":16.551991123593638,"formula_full":"Tl1 Bi1 S2","formula_reduced":"TlBiS2","formula_anonymous":"ABC2","energy_above_hull":0.8855992250000001,"spacegroup":166},{"id":"jvasp-99918","created_at":"2022-09-04T14:36:42.402306Z","updated_at":"2022-09-04T14:36:42.402325Z","structure_string":"Tl1 Bi1 Pb1 S3\n1.0\n5.462767 -0.010751 -5.196325\n-0.502743 3.945104 -6.405243\n0.017835 0.010751 7.539450\nTl Bi Pb S\n1 1 1 3\ndirect\n0.007114 0.007114 -0.000000 Tl\n0.337047 0.337047 -0.000000 Bi\n0.668077 0.668075 -0.000000 Pb\n0.482074 0.982072 0.500000 S\n0.188313 0.688311 0.500000 S\n0.817379 0.317378 0.500000 S\n","nsites":6,"nelements":4,"elements":["Tl","Bi","Pb","S"],"chemical_system":"Bi-Pb-S-Tl","density":7.292282749942522,"density_atomic":0.03676145391500645,"volume":163.21443689012338,"volume_molar":16.38167188360766,"formula_full":"Tl1 Bi1 Pb1 S3","formula_reduced":"TlBiPbS3","formula_anonymous":"ABCD3","energy_above_hull":1.06050462,"spacegroup":44},{"id":"jvasp-103403","created_at":"2022-09-04T14:36:48.872405Z","updated_at":"2022-09-04T14:36:48.872430Z","structure_string":"Tl1 Bi1 F4\n1.0\n4.009621 -0.000000 0.000000\n-0.000000 4.009621 -0.000000\n0.000000 -0.000000 6.652472\nTl Bi F\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Bi\n0.500000 0.000000 0.698833 F\n0.000000 0.500000 0.301166 F\n0.500000 0.000000 0.301166 F\n0.000000 0.500000 0.698833 F\n","nsites":6,"nelements":3,"elements":["Tl","Bi","F"],"chemical_system":"Bi-F-Tl","density":7.597758359168795,"density_atomic":0.05609983026928987,"volume":106.95219524192599,"volume_molar":10.734686238964676,"formula_full":"Tl1 Bi1 F4","formula_reduced":"TlBiF4","formula_anonymous":"ABC4","energy_above_hull":0.0045449999999996,"spacegroup":123},{"id":"jvasp-117728","created_at":"2022-09-04T14:38:51.579071Z","updated_at":"2022-09-04T14:38:51.579095Z","structure_string":"Tl1 Bi1 F2\n1.0\n3.638440 -0.000000 0.000000\n-0.000000 3.638440 -0.000000\n0.000000 0.000000 5.882240\nTl Bi F\n1 1 2\ndirect\n0.500001 0.500001 0.551835 Tl\n0.000000 0.000000 -0.029641 Bi\n0.000000 0.000000 0.351242 F\n0.500001 0.500001 0.136565 F\n","nsites":4,"nelements":3,"elements":["Tl","Bi","F"],"chemical_system":"Bi-F-Tl","density":9.62497207914637,"density_atomic":0.05136730916404349,"volume":77.87053799578727,"volume_molar":11.723683521688983,"formula_full":"Tl1 Bi1 F2","formula_reduced":"TlBiF2","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":99},{"id":"jvasp-117729","created_at":"2022-09-04T14:38:53.921081Z","updated_at":"2022-09-04T14:38:53.921113Z","structure_string":"Tl1 Bi1 F1\n1.0\n3.248749 -0.000000 0.000000\n-0.000000 3.248749 0.000000\n-0.000000 0.000000 8.097129\nTl Bi F\n1 1 1\ndirect\n0.000000 0.000000 0.596111 Tl\n0.000000 0.000000 0.027115 Bi\n0.000000 0.000000 0.301185 F\n","nsites":3,"nelements":3,"elements":["Tl","Bi","F"],"chemical_system":"Bi-F-Tl","density":8.40104560458932,"density_atomic":0.03510410288394106,"volume":85.4600959300515,"volume_molar":17.155090901795774,"formula_full":"Tl1 Bi1 F1","formula_reduced":"TlBiF","formula_anonymous":"ABC","energy_above_hull":0.0,"spacegroup":99},{"id":"jvasp-18565","created_at":"2022-09-04T14:36:43.578407Z","updated_at":"2022-09-04T14:36:43.578420Z","structure_string":"Tl1 Bi1\n1.0\n3.973247 -0.000000 0.000000\n-0.000000 3.973247 -0.000000\n-0.000000 -0.000000 3.973247\nTl Bi\n1 1\ndirect\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Bi\n","nsites":2,"nelements":2,"elements":["Tl","Bi"],"chemical_system":"Bi-Tl","density":10.943210189368092,"density_atomic":0.031885505258161306,"volume":62.72442552837035,"volume_molar":18.88676598109918,"formula_full":"Tl1 Bi1","formula_reduced":"TlBi","formula_anonymous":"AB","energy_above_hull":0.3017447666666666,"spacegroup":221},{"id":"jvasp-51261","created_at":"2022-09-04T14:37:00.494887Z","updated_at":"2022-09-04T14:37:00.494907Z","structure_string":"Tl1 B1 Te2\n1.0\n-0.000000 3.752450 3.752450\n3.752450 -0.000000 3.752450\n3.752450 3.752450 0.000000\nTl B Te\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Tl\n0.500000 0.500000 0.500000 B\n0.000000 0.000000 0.000000 Te\n0.250000 0.250000 0.250000 Te\n","nsites":4,"nelements":3,"elements":["Tl","B","Te"],"chemical_system":"B-Te-Tl","density":7.391565162671542,"density_atomic":0.03785168813627468,"volume":105.67560383566226,"volume_molar":15.90983402990885,"formula_full":"Tl1 B1 Te2","formula_reduced":"TlBTe2","formula_anonymous":"ABC2","energy_above_hull":1.6751001791666669,"spacegroup":216},{"id":"jvasp-120837","created_at":"2022-09-04T14:38:54.173440Z","updated_at":"2022-09-04T14:38:54.173467Z","structure_string":"Tl1 B1 Se2\n1.0\n3.126620 0.000000 0.000000\n0.000000 3.126620 0.000000\n-0.000000 -0.000000 8.820530\nTl B Se\n1 1 2\ndirect\n0.500001 0.500001 0.636388 Tl\n0.000000 0.000000 0.076032 B\n0.000000 0.000000 0.302409 Se\n0.500001 0.500001 0.995171 Se\n","nsites":4,"nelements":3,"elements":["Tl","B","Se"],"chemical_system":"B-Se-Tl","density":7.1853198790692625,"density_atomic":0.04638901026557794,"volume":86.22731929609893,"volume_molar":12.981826353964296,"formula_full":"Tl1 B1 Se2","formula_reduced":"TlBSe2","formula_anonymous":"ABC2","energy_above_hull":1.7161679791666666,"spacegroup":99},{"id":"jvasp-120836","created_at":"2022-09-04T14:38:50.595789Z","updated_at":"2022-09-04T14:38:50.595808Z","structure_string":"Tl1 B1 Se1\n1.0\n5.252958 0.000000 0.000000\n-2.626479 4.549195 0.000000\n-0.000000 0.000000 2.788899\nTl B Se\n1 1 1\ndirect\n0.666667 0.333333 0.000000 Tl\n0.000000 0.000000 0.000000 B\n0.333333 0.666665 0.000000 Se\n","nsites":3,"nelements":3,"elements":["Tl","B","Se"],"chemical_system":"B-Se-Tl","density":7.329140221124429,"density_atomic":0.04501424668275291,"volume":66.64556714995393,"volume_molar":13.37829954690182,"formula_full":"Tl1 B1 Se1","formula_reduced":"TlBSe","formula_anonymous":"ABC","energy_above_hull":1.96352285,"spacegroup":187},{"id":"jvasp-51260","created_at":"2022-09-04T14:36:38.519642Z","updated_at":"2022-09-04T14:36:38.519666Z","structure_string":"Tl1 B1 Cl2\n1.0\n0.000000 3.562212 3.562212\n3.562212 0.000000 3.562212\n3.562212 3.562212 0.000000\nTl B Cl\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Tl\n0.500000 0.500000 0.500000 B\n0.000000 0.000000 0.000000 Cl\n0.750000 0.750000 0.750000 Cl\n","nsites":4,"nelements":3,"elements":["Tl","B","Cl"],"chemical_system":"B-Cl-Tl","density":5.255065433849628,"density_atomic":0.04424566315601818,"volume":90.40434055413023,"volume_molar":13.610691603298717,"formula_full":"Tl1 B1 Cl2","formula_reduced":"TlBCl2","formula_anonymous":"ABC2","energy_above_hull":1.1526033295833331,"spacegroup":216}]}