{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_reduced&page=614","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_reduced&page=612","results":[{"id":"jvasp-71342","created_at":"2022-09-04T14:36:10.654553Z","updated_at":"2022-09-04T14:36:10.654580Z","structure_string":"Ti1 Be2 Br1\n1.0\n3.398415 0.000000 0.000000\n-0.000000 3.398415 0.000000\n-0.000000 -0.000000 5.244224\nTi Be Br\n1 2 1\ndirect\n0.500001 0.500001 0.500000 Ti\n0.000000 0.000000 0.682885 Be\n0.000000 0.000000 0.317114 Be\n0.500001 0.500001 0.000000 Br\n","nsites":4,"nelements":3,"elements":["Ti","Be","Br"],"chemical_system":"Be-Br-Ti","density":3.9972264665908015,"density_atomic":0.06604286934590312,"volume":60.566720368398634,"volume_molar":9.11853288575139,"formula_full":"Ti1 Be2 Br1","formula_reduced":"TiBe2Br","formula_anonymous":"ABC2","energy_above_hull":1.942563659583333,"spacegroup":123},{"id":"jvasp-74880","created_at":"2022-09-04T14:35:48.674871Z","updated_at":"2022-09-04T14:35:48.674897Z","structure_string":"Ti1 Be2 Br1\n1.0\n2.951164 0.000000 0.000000\n0.000000 2.951164 -0.000000\n0.000000 -0.000000 7.784401\nTi Be Br\n1 2 1\ndirect\n0.499999 0.499999 0.785719 Ti\n0.000000 0.000000 0.016898 Be\n0.499999 0.499999 0.124522 Be\n0.000000 0.000000 0.572861 Br\n","nsites":4,"nelements":3,"elements":["Ti","Be","Br"],"chemical_system":"Be-Br-Ti","density":3.570926598703453,"density_atomic":0.05899946895006008,"volume":67.79722040186138,"volume_molar":10.207110109918826,"formula_full":"Ti1 Be2 Br1","formula_reduced":"TiBe2Br","formula_anonymous":"ABC2","energy_above_hull":1.885213659583333,"spacegroup":99},{"id":"jvasp-73310","created_at":"2022-09-04T14:35:48.541007Z","updated_at":"2022-09-04T14:35:48.541036Z","structure_string":"Ti1 Be2 Bi1\n1.0\n-1.939548 1.939548 4.260512\n1.939548 -1.939548 4.260512\n1.939548 1.939548 -4.260512\nTi Be Bi\n1 2 1\ndirect\n0.750000 0.250000 0.500001 Ti\n0.000000 0.000000 0.000000 Be\n0.500000 0.500000 0.000000 Be\n0.250000 0.750000 0.500001 Bi\n","nsites":4,"nelements":3,"elements":["Ti","Be","Bi"],"chemical_system":"Be-Bi-Ti","density":7.119612859647205,"density_atomic":0.06239318318969771,"volume":64.1095676724581,"volume_molar":9.651921014657207,"formula_full":"Ti1 Be2 Bi1","formula_reduced":"TiBe2Bi","formula_anonymous":"ABC2","energy_above_hull":2.213621208333333,"spacegroup":139},{"id":"jvasp-68697","created_at":"2022-09-04T14:35:57.537823Z","updated_at":"2022-09-04T14:35:57.537837Z","structure_string":"Ti1 Be2 Bi1\n1.0\n3.455813 -0.000000 -0.000000\n-0.000000 3.455813 -0.000000\n-0.000000 -0.000000 5.521822\nTi Be Bi\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Ti\n0.000000 0.000000 0.184499 Be\n0.000000 0.000000 0.815501 Be\n0.500000 0.500000 0.500000 Bi\n","nsites":4,"nelements":3,"elements":["Ti","Be","Bi"],"chemical_system":"Be-Bi-Ti","density":6.921438370891615,"density_atomic":0.06065646836766946,"volume":65.94515156658943,"volume_molar":9.928274629338402,"formula_full":"Ti1 Be2 Bi1","formula_reduced":"TiBe2Bi","formula_anonymous":"ABC2","energy_above_hull":2.188966208333334,"spacegroup":123},{"id":"jvasp-15044","created_at":"2022-09-04T14:36:01.915665Z","updated_at":"2022-09-04T14:36:01.915691Z","structure_string":"Ti2 Be4\n1.0\n3.933225 -0.000000 2.270848\n1.311075 3.708280 2.270848\n0.000000 0.000000 4.541697\nTi Be\n2 4\ndirect\n0.875002 0.875000 0.875000 Ti\n0.125000 0.125000 0.125000 Ti\n0.500001 0.500000 0.500000 Be\n0.500001 0.500000 -0.000000 Be\n0.000001 0.500000 0.500000 Be\n0.500001 -0.000000 0.500000 Be\n","nsites":6,"nelements":2,"elements":["Ti","Be"],"chemical_system":"Be-Ti","density":3.303452940168888,"density_atomic":0.09057571766130595,"volume":66.2429197904463,"volume_molar":6.648736455524287,"formula_full":"Ti2 Be4","formula_reduced":"TiBe2","formula_anonymous":"AB2","energy_above_hull":2.1597001777777773,"spacegroup":227},{"id":"jvasp-58273","created_at":"2022-09-04T14:37:19.577673Z","updated_at":"2022-09-04T14:37:19.577701Z","structure_string":"Ti1 Be12\n1.0\n2.117151 -3.667013 0.000000\n2.117151 3.667013 -0.000000\n-0.000000 0.000000 7.326035\nTi Be\n1 12\ndirect\n0.000000 0.000000 0.000000 Ti\n0.333333 0.666667 0.000000 Be\n0.666667 0.333333 0.000000 Be\n0.333333 0.666667 0.500000 Be\n0.666667 0.333333 0.500000 Be\n0.000000 0.000000 0.654127 Be\n0.000000 0.000000 0.345873 Be\n0.500000 0.500000 0.759145 Be\n0.500000 0.000000 0.759145 Be\n0.000000 0.500000 0.759145 Be\n0.500000 0.500000 0.240856 Be\n0.500000 0.000000 0.240856 Be\n0.000000 0.500000 0.240856 Be\n","nsites":13,"nelements":2,"elements":["Ti","Be"],"chemical_system":"Be-Ti","density":2.2774409709957295,"density_atomic":0.11428259252799491,"volume":113.75310720935467,"volume_molar":5.269517103862343,"formula_full":"Ti1 Be12","formula_reduced":"TiBe12","formula_anonymous":"AB12","energy_above_hull":2.4417955025641027,"spacegroup":191},{"id":"jvasp-16462","created_at":"2022-09-04T14:38:14.080178Z","updated_at":"2022-09-04T14:38:14.080202Z","structure_string":"Ti1 Be1\n1.0\n2.928880 -0.000000 0.000000\n-0.000000 2.928880 -0.000000\n0.000000 -0.000000 2.928880\nTi Be\n1 1\ndirect\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Be\n","nsites":2,"nelements":2,"elements":["Ti","Be"],"chemical_system":"Be-Ti","density":3.759219667521592,"density_atomic":0.07960223476279539,"volume":25.12492276077107,"volume_molar":7.565291072474559,"formula_full":"Ti1 Be1","formula_reduced":"TiBe","formula_anonymous":"AB","energy_above_hull":1.8202272166666664,"spacegroup":221},{"id":"jvasp-105371","created_at":"2022-09-04T14:36:52.762763Z","updated_at":"2022-09-04T14:36:52.762782Z","structure_string":"Ti1 B4 Mo1\n1.0\n3.047702 -0.000000 0.000000\n-1.523851 2.639388 0.000000\n0.000000 -0.000000 6.480542\nTi B Mo\n1 4 1\ndirect\n0.000000 0.000000 0.500000 Ti\n0.666666 0.333334 0.743749 B\n0.666666 0.333334 0.256251 B\n0.333334 0.666667 0.743749 B\n0.333334 0.666667 0.256251 B\n0.000000 0.000000 0.000000 Mo\n","nsites":6,"nelements":3,"elements":["Ti","B","Mo"],"chemical_system":"B-Mo-Ti","density":5.9582958593474515,"density_atomic":0.11509704743770031,"volume":52.12992108461929,"volume_molar":5.232228709654487,"formula_full":"Ti1 B4 Mo1","formula_reduced":"TiB4Mo","formula_anonymous":"ABC4","energy_above_hull":5.014807427777779,"spacegroup":191},{"id":"jvasp-100536","created_at":"2022-09-04T14:36:38.694986Z","updated_at":"2022-09-04T14:36:38.695017Z","structure_string":"Ti1 B2 W1\n1.0\n4.514680 -0.000483 0.000000\n-3.385303 2.986981 0.000000\n0.000000 0.000000 3.079927\nTi B W\n1 2 1\ndirect\n0.146928 0.853072 0.500000 Ti\n0.440474 0.559527 0.500000 B\n0.559874 0.440127 0.000000 B\n0.852726 0.147275 0.000000 W\n","nsites":4,"nelements":3,"elements":["Ti","B","W"],"chemical_system":"B-Ti-W","density":10.129472084953749,"density_atomic":0.09631918452472923,"volume":41.528590796707064,"volume_molar":6.2522754835552625,"formula_full":"Ti1 B2 W1","formula_reduced":"TiB2W","formula_anonymous":"ABC2","energy_above_hull":4.972438374999999,"spacegroup":38},{"id":"jvasp-103410","created_at":"2022-09-04T14:36:38.511264Z","updated_at":"2022-09-04T14:36:38.511289Z","structure_string":"Ti1 B2 Mo1\n1.0\n4.520139 0.002220 0.000000\n-3.398521 2.980221 0.000000\n0.000000 0.000000 3.080710\nTi B Mo\n1 2 1\ndirect\n0.852486 0.147514 0.000000 Ti\n0.441878 0.558121 0.500000 B\n0.558887 0.441113 0.000000 B\n0.146749 0.853251 0.500000 Mo\n","nsites":4,"nelements":3,"elements":["Ti","B","Mo"],"chemical_system":"B-Mo-Ti","density":6.615558215366695,"density_atomic":0.09633092817506102,"volume":41.52352806910413,"volume_molar":6.251513272098903,"formula_full":"Ti1 B2 Mo1","formula_reduced":"TiB2Mo","formula_anonymous":"ABC2","energy_above_hull":4.48913985,"spacegroup":38},{"id":"jvasp-20096","created_at":"2022-09-04T14:35:42.163913Z","updated_at":"2022-09-04T14:35:42.163932Z","structure_string":"Ti1 B2\n1.0\n1.515693 -2.625257 -0.000000\n1.515693 2.625257 0.000000\n0.000000 0.000000 3.243004\nTi B\n1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.333332 0.666666 0.499999 B\n0.666666 0.333332 0.499999 B\n","nsites":3,"nelements":2,"elements":["Ti","B"],"chemical_system":"B-Ti","density":4.470999376469537,"density_atomic":0.11624136593824842,"volume":25.80836843911235,"volume_molar":5.180720917542535,"formula_full":"Ti1 B2","formula_reduced":"TiB2","formula_anonymous":"AB2","energy_above_hull":3.431641166666667,"spacegroup":191},{"id":"jvasp-116736","created_at":"2022-09-04T14:38:44.508870Z","updated_at":"2022-09-04T14:38:44.508902Z","structure_string":"Ti1 B12\n1.0\n4.503351 -0.000000 2.600010\n1.501117 4.245800 2.600010\n-0.000000 -0.000000 5.200021\nTi B\n1 12\ndirect\n0.000000 0.000000 0.000000 Ti\n0.840004 0.500000 0.500000 B\n0.500000 0.500000 0.840004 B\n0.840004 0.159996 0.500000 B\n0.500000 0.840004 0.159995 B\n0.500000 0.159996 0.840004 B\n0.500000 0.840004 0.500000 B\n0.840004 0.500000 0.159996 B\n0.159996 0.840004 0.500000 B\n0.500000 0.159996 0.500000 B\n0.159996 0.500000 0.840004 B\n0.500000 0.500000 0.159996 B\n0.159996 0.500000 0.500000 B\n","nsites":13,"nelements":2,"elements":["Ti","B"],"chemical_system":"B-Ti","density":2.9661231965278216,"density_atomic":0.13075036925497283,"volume":99.4261054410412,"volume_molar":4.605830786035016,"formula_full":"Ti1 B12","formula_reduced":"TiB12","formula_anonymous":"AB12","energy_above_hull":5.430827641025641,"spacegroup":225}]}