{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=formula_full&page=3450","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=formula_full&page=3448","results":[{"id":"jvasp-67920","created_at":"2022-09-04T14:36:01.916208Z","updated_at":"2022-09-04T14:36:01.916239Z","structure_string":"Sc2 Be1 Ru1\n1.0\n-2.020160 2.020160 3.878236\n2.020160 -2.020160 3.878236\n2.020160 2.020160 -3.878236\nSc Be Ru\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.250000 0.750000 0.500000 Sc\n0.500001 0.500001 0.000000 Be\n0.750000 0.250000 0.500000 Ru\n","nsites":4,"nelements":3,"elements":["Sc","Be","Ru"],"chemical_system":"Be-Ru-Sc","density":5.245662161279944,"density_atomic":0.06318212541939985,"volume":63.309044661732976,"volume_molar":9.531399458352064,"formula_full":"Sc2 Be1 Ru1","formula_reduced":"Sc2BeRu","formula_anonymous":"ABC2","energy_above_hull":2.8413367750000003,"spacegroup":119},{"id":"jvasp-70850","created_at":"2022-09-04T14:35:41.215924Z","updated_at":"2022-09-04T14:35:41.215960Z","structure_string":"Sc2 Be1 Ru1\n1.0\n3.124595 -0.000000 0.000000\n0.000000 3.124595 0.000000\n0.000000 -0.000000 6.953174\nSc Be Ru\n2 1 1\ndirect\n0.000000 0.000000 0.941551 Sc\n0.500001 0.500001 0.317317 Sc\n0.000000 0.000000 0.559371 Be\n0.500001 0.500001 0.681761 Ru\n","nsites":4,"nelements":3,"elements":["Sc","Be","Ru"],"chemical_system":"Be-Ru-Sc","density":4.892102103416093,"density_atomic":0.05892362091940868,"volume":67.88449076255685,"volume_molar":10.220248969825928,"formula_full":"Sc2 Be1 Ru1","formula_reduced":"Sc2BeRu","formula_anonymous":"ABC2","energy_above_hull":2.8081142750000003,"spacegroup":99},{"id":"jvasp-68869","created_at":"2022-09-04T14:36:16.310545Z","updated_at":"2022-09-04T14:36:16.310557Z","structure_string":"Sc2 Be1 Sb1\n1.0\n-2.016055 2.016055 4.885612\n2.016055 -2.016055 4.885612\n2.016055 2.016055 -4.885612\nSc Be Sb\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.250000 0.749999 0.499999 Sc\n0.500000 0.500000 0.000000 Be\n0.749999 0.250000 0.499999 Sb\n","nsites":4,"nelements":3,"elements":["Sc","Be","Sb"],"chemical_system":"Be-Sb-Sc","density":4.613560706424218,"density_atomic":0.05035890455694023,"volume":79.4298453310724,"volume_molar":11.95844272821867,"formula_full":"Sc2 Be1 Sb1","formula_reduced":"Sc2BeSb","formula_anonymous":"ABC2","energy_above_hull":2.086040675,"spacegroup":119},{"id":"jvasp-74622","created_at":"2022-09-04T14:35:51.118271Z","updated_at":"2022-09-04T14:35:51.118295Z","structure_string":"Sc2 Be1 Tc1\n1.0\n-2.264719 2.264719 3.202179\n2.264719 -2.264719 3.202179\n2.264719 2.264719 -3.202179\nSc Be Tc\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.500000 0.500000 0.000000 Sc\n0.750000 0.250000 0.500000 Be\n0.250000 0.750000 0.500000 Tc\n","nsites":4,"nelements":3,"elements":["Sc","Be","Tc"],"chemical_system":"Be-Sc-Tc","density":4.977525753808018,"density_atomic":0.060887164231903414,"volume":65.69529145363114,"volume_molar":9.890657310074795,"formula_full":"Sc2 Be1 Tc1","formula_reduced":"Sc2BeTc","formula_anonymous":"ABC2","energy_above_hull":3.078712025,"spacegroup":225},{"id":"jvasp-41912","created_at":"2022-09-04T14:37:40.946705Z","updated_at":"2022-09-04T14:37:40.946724Z","structure_string":"Sc2 Be1 Tc1\n1.0\n-0.000000 3.202320 3.202320\n3.202320 -0.000000 3.202320\n3.202320 3.202320 -0.000000\nSc Be Tc\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.499999 0.499999 0.499999 Sc\n0.250001 0.250001 0.250001 Be\n0.750000 0.750000 0.750000 Tc\n","nsites":4,"nelements":3,"elements":["Sc","Be","Tc"],"chemical_system":"Be-Sc-Tc","density":4.978787386089225,"density_atomic":0.06090259704244134,"volume":65.67864416705433,"volume_molar":9.888151002498853,"formula_full":"Sc2 Be1 Tc1","formula_reduced":"Sc2BeTc","formula_anonymous":"ABC2","energy_above_hull":3.078717025,"spacegroup":225},{"id":"jvasp-74472","created_at":"2022-09-04T14:35:52.350579Z","updated_at":"2022-09-04T14:35:52.350604Z","structure_string":"Sc2 Be1 Te1\n1.0\n4.434815 0.000000 0.000000\n0.000000 4.434815 -0.000000\n0.000000 0.000000 3.981577\nSc Be Te\n2 1 1\ndirect\n0.499999 0.000000 0.000000 Sc\n0.000000 0.499999 0.000000 Sc\n0.000000 0.000000 0.500000 Be\n0.499999 0.499999 0.500000 Te\n","nsites":4,"nelements":3,"elements":["Sc","Be","Te"],"chemical_system":"Be-Sc-Te","density":4.803493377364939,"density_atomic":0.05108034910563276,"volume":78.30800043531633,"volume_molar":11.789545031390404,"formula_full":"Sc2 Be1 Te1","formula_reduced":"Sc2BeTe","formula_anonymous":"ABC2","energy_above_hull":1.926326091666667,"spacegroup":123},{"id":"jvasp-74711","created_at":"2022-09-04T14:35:54.528362Z","updated_at":"2022-09-04T14:35:54.528392Z","structure_string":"Sc2 Be1 V1\n1.0\n-2.310100 2.310100 3.267510\n2.310100 -2.310100 3.267510\n2.310100 2.310100 -3.267510\nSc Be V\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.500000 0.500000 0.000000 Sc\n0.750000 0.250000 0.500000 Be\n0.250000 0.750000 0.500000 V\n","nsites":4,"nelements":3,"elements":["Sc","Be","V"],"chemical_system":"Be-Sc-V","density":3.5678969709002493,"density_atomic":0.05734842755173871,"volume":69.74907893318039,"volume_molar":10.500969280399074,"formula_full":"Sc2 Be1 V1","formula_reduced":"Sc2BeV","formula_anonymous":"ABC2","energy_above_hull":2.8841452,"spacegroup":225},{"id":"jvasp-71951","created_at":"2022-09-04T14:35:48.110762Z","updated_at":"2022-09-04T14:35:48.110787Z","structure_string":"Sc2 Be2 Pd1\n1.0\n-1.526634 1.526634 8.556278\n1.526634 -1.526634 8.556278\n1.526634 1.526634 -8.556278\nSc Be Pd\n2 2 1\ndirect\n0.605932 0.605932 0.000000 Sc\n0.394069 0.394069 0.000000 Sc\n0.749999 0.250000 0.499999 Be\n0.250000 0.749999 0.499999 Be\n0.000000 0.000000 0.000000 Pd\n","nsites":5,"nelements":3,"elements":["Sc","Be","Pd"],"chemical_system":"Be-Pd-Sc","density":4.46241938759795,"density_atomic":0.06268379266838497,"volume":79.76543516521754,"volume_molar":9.607173566951877,"formula_full":"Sc2 Be2 Pd1","formula_reduced":"Sc2Be2Pd","formula_anonymous":"AB2C2","energy_above_hull":2.22894168,"spacegroup":139},{"id":"jvasp-50884","created_at":"2022-09-04T14:37:17.075980Z","updated_at":"2022-09-04T14:37:17.076006Z","structure_string":"Sc2 Bi2 O6\n1.0\n5.760608 0.000018 -0.000094\n-2.880398 1.662911 4.808941\n2.880289 -4.988773 -0.000028\nSc Bi O\n2 2 6\ndirect\n0.220645 0.661951 0.220655 Sc\n0.720648 0.161952 0.720650 Sc\n0.001177 0.003528 0.001168 Bi\n0.501168 0.503528 0.501177 Bi\n0.051601 0.356593 0.429437 O\n0.551601 0.856578 0.375553 O\n0.375560 0.856578 0.929418 O\n0.429426 0.356581 0.875559 O\n0.875556 0.356576 0.051602 O\n0.929440 0.856595 0.551599 O\n","nsites":10,"nelements":3,"elements":["Sc","Bi","O"],"chemical_system":"Bi-O-Sc","density":7.2557652671700374,"density_atomic":0.07235880304984334,"volume":138.20018544407986,"volume_molar":8.322609698023522,"formula_full":"Sc2 Bi2 O6","formula_reduced":"ScBiO3","formula_anonymous":"ABC3","energy_above_hull":1.77049001,"spacegroup":161},{"id":"jvasp-109432","created_at":"2022-09-04T14:38:17.925272Z","updated_at":"2022-09-04T14:38:17.925301Z","structure_string":"Sc2 Bi2 O6\n1.0\n5.000705 -0.017753 3.263243\n1.758046 4.681522 3.263243\n-0.025727 -0.017753 5.971194\nSc Bi O\n2 2 6\ndirect\n0.852015 0.852014 0.852012 Sc\n0.147986 0.147986 0.147986 Sc\n0.636458 0.636458 0.636456 Bi\n0.363543 0.363543 0.363542 Bi\n0.553342 0.983398 0.202622 O\n0.797377 0.446660 0.016601 O\n0.016603 0.797376 0.446659 O\n0.983398 0.202625 0.553339 O\n0.202624 0.553341 0.983397 O\n0.446659 0.016603 0.797375 O\n","nsites":10,"nelements":3,"elements":["Sc","Bi","O"],"chemical_system":"Bi-O-Sc","density":7.133959401203608,"density_atomic":0.07114408257016358,"volume":140.55982786956062,"volume_molar":8.46471068631865,"formula_full":"Sc2 Bi2 O6","formula_reduced":"ScBiO3","formula_anonymous":"ABC3","energy_above_hull":1.78080001,"spacegroup":148},{"id":"jvasp-12112","created_at":"2022-09-04T14:36:05.450150Z","updated_at":"2022-09-04T14:36:05.450175Z","structure_string":"Sc2 Br2 O2\n1.0\n3.562931 0.000000 0.000000\n0.000000 3.963851 0.000000\n0.000000 0.000000 8.680819\nSc Br O\n2 2 2\ndirect\n0.250000 0.750000 0.607170 Sc\n0.750000 0.250000 0.392831 Sc\n0.750000 0.750000 0.834708 Br\n0.250000 0.250000 0.165292 Br\n0.750000 0.750000 0.467440 O\n0.250000 0.250000 0.532560 O\n","nsites":6,"nelements":3,"elements":["Sc","Br","O"],"chemical_system":"Br-O-Sc","density":3.8157439294448987,"density_atomic":0.04894020862853652,"volume":122.59857830890944,"volume_molar":12.305098259202257,"formula_full":"Sc2 Br2 O2","formula_reduced":"ScBrO","formula_anonymous":"ABC","energy_above_hull":0.4749142849999999,"spacegroup":59},{"id":"jvasp-30493","created_at":"2022-09-04T14:38:02.230469Z","updated_at":"2022-09-04T14:38:02.230500Z","structure_string":"Sc2 Br2 O2\n1.0\n3.614917 0.000000 0.000000\n0.000000 3.614917 0.000000\n-0.000000 0.000000 8.362346\nSc Br O\n2 2 2\ndirect\n0.000000 0.500000 0.124730 Sc\n0.500000 0.000000 0.875270 Sc\n0.000000 0.500000 0.678253 Br\n0.500000 0.000000 0.321747 Br\n0.000000 0.000000 0.000000 O\n0.500000 0.500000 0.000000 O\n","nsites":6,"nelements":3,"elements":["Sc","Br","O"],"chemical_system":"Br-O-Sc","density":4.280947114279401,"density_atomic":0.05490684091346878,"volume":109.27600095324708,"volume_molar":10.967924323839135,"formula_full":"Sc2 Br2 O2","formula_reduced":"ScBrO","formula_anonymous":"ABC","energy_above_hull":0.4903309516666665,"spacegroup":129}]}