{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-chemical_system&page=3537","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-chemical_system&page=3535","results":[{"id":"jvasp-70317","created_at":"2022-09-04T14:35:58.663679Z","updated_at":"2022-09-04T14:35:58.663699Z","structure_string":"Ti1 Be2 Cl1\n1.0\n2.826653 0.000000 0.000000\n0.000000 2.826653 -0.000000\n0.000000 -0.000000 7.703608\nTi Be Cl\n1 2 1\ndirect\n0.499999 0.499999 0.778970 Ti\n0.000000 0.000000 0.013584 Be\n0.499999 0.499999 0.132004 Be\n0.000000 0.000000 0.575442 Cl\n","nsites":4,"nelements":3,"elements":["Ti","Be","Cl"],"chemical_system":"Be-Cl-Ti","density":2.7340693607194804,"density_atomic":0.06498615174513646,"volume":61.551575106143424,"volume_molar":9.266806232222692,"formula_full":"Ti1 Be2 Cl1","formula_reduced":"TiBe2Cl","formula_anonymous":"ABC2","energy_above_hull":1.8613211502083336,"spacegroup":99},{"id":"jvasp-71004","created_at":"2022-09-04T14:35:57.262437Z","updated_at":"2022-09-04T14:35:57.262455Z","structure_string":"Ti2 Be1 Cl1\n1.0\n2.912112 0.000000 0.000000\n0.000000 2.912112 0.000000\n0.000000 0.000000 8.459932\nTi Be Cl\n2 1 1\ndirect\n0.000000 0.000000 0.999196 Ti\n0.500000 0.500000 0.251970 Ti\n0.000000 0.000000 0.429403 Be\n0.500000 0.500000 0.819430 Cl\n","nsites":4,"nelements":3,"elements":["Ti","Be","Cl"],"chemical_system":"Be-Cl-Ti","density":3.2449765077317547,"density_atomic":0.05575412073148058,"volume":71.74357603565382,"volume_molar":10.80124783781175,"formula_full":"Ti2 Be1 Cl1","formula_reduced":"Ti2BeCl","formula_anonymous":"ABC2","energy_above_hull":2.348746708541667,"spacegroup":99},{"id":"jvasp-68506","created_at":"2022-09-04T14:36:17.325681Z","updated_at":"2022-09-04T14:36:17.325699Z","structure_string":"Ti1 Be2 Cl1\n1.0\n2.923007 0.000000 -0.000000\n0.000000 2.923007 0.000000\n-0.000000 0.000000 6.793654\nTi Be Cl\n1 2 1\ndirect\n0.500001 0.500001 0.500000 Ti\n0.000000 0.000000 0.733910 Be\n0.000000 0.000000 0.266090 Be\n0.500001 0.500001 0.000000 Cl\n","nsites":4,"nelements":3,"elements":["Ti","Be","Cl"],"chemical_system":"Be-Cl-Ti","density":2.899249318053445,"density_atomic":0.06891231760134407,"volume":58.04477543680789,"volume_molar":8.73884520157619,"formula_full":"Ti1 Be2 Cl1","formula_reduced":"TiBe2Cl","formula_anonymous":"ABC2","energy_above_hull":1.9677486502083332,"spacegroup":123},{"id":"jvasp-70391","created_at":"2022-09-04T14:35:55.506908Z","updated_at":"2022-09-04T14:35:55.506931Z","structure_string":"Ti1 Be2 Cl1\n1.0\n3.292969 -0.000000 0.000000\n0.000000 3.292969 0.000000\n0.000000 0.000000 5.315155\nTi Be Cl\n1 2 1\ndirect\n0.000000 0.000000 0.500000 Ti\n0.000000 0.500000 0.000000 Be\n0.500000 0.000000 0.000000 Be\n0.500000 0.500000 0.500000 Cl\n","nsites":4,"nelements":3,"elements":["Ti","Be","Cl"],"chemical_system":"Be-Cl-Ti","density":2.9198294225704586,"density_atomic":0.06940148653549337,"volume":57.635653062767126,"volume_molar":8.677250388462719,"formula_full":"Ti1 Be2 Cl1","formula_reduced":"TiBe2Cl","formula_anonymous":"ABC2","energy_above_hull":1.9809111502083332,"spacegroup":123},{"id":"jvasp-71825","created_at":"2022-09-04T14:36:03.492059Z","updated_at":"2022-09-04T14:36:03.492076Z","structure_string":"Ti1 Be1 Cl2\n1.0\n-1.725997 1.725997 5.473664\n1.725997 -1.725997 5.473664\n1.725997 1.725997 -5.473664\nTi Be Cl\n1 1 2\ndirect\n0.500000 0.500000 0.000000 Ti\n0.750001 0.250000 0.500001 Be\n0.000000 0.000000 0.000000 Cl\n0.250000 0.750001 0.500001 Cl\n","nsites":4,"nelements":3,"elements":["Ti","Be","Cl"],"chemical_system":"Be-Cl-Ti","density":3.2532047231048358,"density_atomic":0.061325598050654934,"volume":65.22561747699551,"volume_molar":9.819946240109577,"formula_full":"Ti1 Be1 Cl2","formula_reduced":"TiBeCl2","formula_anonymous":"ABC2","energy_above_hull":1.4497031420833335,"spacegroup":119},{"id":"jvasp-70416","created_at":"2022-09-04T14:36:11.959803Z","updated_at":"2022-09-04T14:36:11.959829Z","structure_string":"Be2 Te1 Cl1\n1.0\n-1.757561 1.757561 6.809692\n1.757561 -1.757561 6.809692\n1.757561 1.757561 -6.809692\nBe Te Cl\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.750000 0.500000 Be\n0.750000 0.250000 0.500000 Te\n0.500000 0.500000 0.000000 Cl\n","nsites":4,"nelements":3,"elements":["Be","Te","Cl"],"chemical_system":"Be-Cl-Te","density":3.5735921567930546,"density_atomic":0.04753918329510662,"volume":84.14111734249617,"volume_molar":12.667741308504727,"formula_full":"Be2 Te1 Cl1","formula_reduced":"Be2TeCl","formula_anonymous":"ABC2","energy_above_hull":1.2501485085416668,"spacegroup":119},{"id":"jvasp-119980","created_at":"2022-09-04T14:38:53.294968Z","updated_at":"2022-09-04T14:38:53.294985Z","structure_string":"Be1 Te1 Cl1\n1.0\n4.967858 0.000000 0.000000\n-2.483929 4.302291 -0.000000\n-0.000000 -0.000000 3.260466\nBe Te Cl\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.666666 0.333333 0.000000 Te\n0.333332 0.666666 0.000000 Cl\n","nsites":3,"nelements":3,"elements":["Be","Te","Cl"],"chemical_system":"Be-Cl-Te","density":4.10009070220108,"density_atomic":0.043049947221666746,"volume":69.6864965839057,"volume_molar":13.98872971665131,"formula_full":"Be1 Te1 Cl1","formula_reduced":"BeTeCl","formula_anonymous":"ABC","energy_above_hull":0.9959693113888888,"spacegroup":187},{"id":"jvasp-119979","created_at":"2022-09-04T14:38:52.457196Z","updated_at":"2022-09-04T14:38:52.457225Z","structure_string":"Be1 Te1 Cl1\n1.0\n3.519242 -0.000000 0.000000\n-0.000000 3.519242 -0.000000\n0.000000 0.000000 7.755778\nBe Te Cl\n1 1 1\ndirect\n0.000000 0.000000 0.347133 Be\n0.000000 0.000000 0.058231 Te\n0.000000 0.000000 0.578704 Cl\n","nsites":3,"nelements":3,"elements":["Be","Te","Cl"],"chemical_system":"Be-Cl-Te","density":2.9745307447989084,"density_atomic":0.031231843603868152,"volume":96.05580887413389,"volume_molar":19.282053395189713,"formula_full":"Be1 Te1 Cl1","formula_reduced":"BeTeCl","formula_anonymous":"ABC","energy_above_hull":0.7071059780555556,"spacegroup":99},{"id":"jvasp-65207","created_at":"2022-09-04T14:36:17.612633Z","updated_at":"2022-09-04T14:36:17.612652Z","structure_string":"Be1 Te1 Cl4\n1.0\n0.000000 4.123855 4.123855\n4.123855 0.000000 4.123855\n4.123855 4.123855 -0.000000\nBe Te Cl\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Te\n0.124682 0.625107 0.625107 Cl\n0.625107 0.625107 0.625107 Cl\n0.625107 0.124682 0.625107 Cl\n0.625107 0.625107 0.124682 Cl\n","nsites":6,"nelements":3,"elements":["Be","Te","Cl"],"chemical_system":"Be-Cl-Te","density":3.2962177567328568,"density_atomic":0.04277707598009545,"volume":140.2620413511165,"volume_molar":14.077962605022735,"formula_full":"Be1 Te1 Cl4","formula_reduced":"BeTeCl4","formula_anonymous":"ABC4","energy_above_hull":0.7240950227777778,"spacegroup":216},{"id":"jvasp-71459","created_at":"2022-09-04T14:36:17.345311Z","updated_at":"2022-09-04T14:36:17.345320Z","structure_string":"Be2 Tc1 Cl1\n1.0\n3.075830 0.000000 0.000000\n0.000000 3.075830 -0.000000\n0.000000 -0.000000 5.592353\nBe Tc Cl\n2 1 1\ndirect\n0.000000 0.000000 0.680005 Be\n0.000000 0.000000 0.319995 Be\n0.500000 0.500000 0.500000 Tc\n0.500000 0.500000 0.000000 Cl\n","nsites":4,"nelements":3,"elements":["Be","Tc","Cl"],"chemical_system":"Be-Cl-Tc","density":4.754201692582038,"density_atomic":0.07560330084448356,"volume":52.90774285408548,"volume_molar":7.965446869029672,"formula_full":"Be2 Tc1 Cl1","formula_reduced":"Be2TcCl","formula_anonymous":"ABC2","energy_above_hull":2.339899441875,"spacegroup":123},{"id":"jvasp-65033","created_at":"2022-09-04T14:36:00.287476Z","updated_at":"2022-09-04T14:36:00.287505Z","structure_string":"Be1 Tc1 Cl4\n1.0\n-0.000000 4.087140 4.087140\n4.087140 0.000000 4.087140\n4.087140 4.087140 0.000000\nBe Tc Cl\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Tc\n0.124933 0.625022 0.625022 Cl\n0.625022 0.625022 0.625022 Cl\n0.625022 0.124933 0.625022 Cl\n0.625022 0.625022 0.124933 Cl\n","nsites":6,"nelements":3,"elements":["Be","Tc","Cl"],"chemical_system":"Be-Cl-Tc","density":3.025890056726099,"density_atomic":0.04394026908249505,"volume":136.54900448459665,"volume_molar":13.705288760735206,"formula_full":"Be1 Tc1 Cl4","formula_reduced":"BeTcCl4","formula_anonymous":"ABC4","energy_above_hull":1.629815645,"spacegroup":216},{"id":"jvasp-72018","created_at":"2022-09-04T14:36:20.059022Z","updated_at":"2022-09-04T14:36:20.059049Z","structure_string":"Ta1 Be2 Cl1\n1.0\n2.866463 -0.000000 0.000000\n-0.000000 2.866463 -0.000000\n-0.000000 0.000000 7.185627\nTa Be Cl\n1 2 1\ndirect\n0.499999 0.499999 0.500000 Ta\n0.000000 0.000000 0.739249 Be\n0.000000 0.000000 0.260752 Be\n0.499999 0.499999 0.000000 Cl\n","nsites":4,"nelements":3,"elements":["Ta","Be","Cl"],"chemical_system":"Be-Cl-Ta","density":6.593198087125962,"density_atomic":0.06774896129011863,"volume":59.04149560125301,"volume_molar":8.888904929791662,"formula_full":"Ta1 Be2 Cl1","formula_reduced":"TaBe2Cl","formula_anonymous":"ABC2","energy_above_hull":2.691271366875,"spacegroup":123}]}