{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=density_atomic&page=4638","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=density_atomic&page=4636","results":[{"id":"jvasp-55730","created_at":"2022-09-04T14:38:36.904119Z","updated_at":"2022-09-04T14:38:36.904134Z","structure_string":"Li4 Be4 H12\n1.0\n4.388421 0.000000 0.000000\n-0.000000 4.530747 0.000000\n0.000000 0.000000 6.282258\nLi Be H\n4 4 12\ndirect\n0.489789 0.446797 0.750000 Li\n0.989789 0.053204 0.250000 Li\n0.010210 0.946797 0.750000 Li\n0.510210 0.553204 0.250000 Li\n0.500000 0.000000 0.000000 Be\n0.000000 0.500000 0.000000 Be\n0.000000 0.500000 0.500000 Be\n0.500000 0.000000 0.500000 Be\n0.794340 0.795199 0.040458 H\n0.294340 0.704802 0.959542 H\n0.705660 0.295199 0.040458 H\n0.205660 0.204802 0.959542 H\n0.794340 0.795199 0.459542 H\n0.079315 0.479748 0.250000 H\n0.420685 0.979748 0.250000 H\n0.920685 0.520253 0.750000 H\n0.205660 0.204802 0.540458 H\n0.579315 0.020253 0.750000 H\n0.294340 0.704802 0.540458 H\n0.705660 0.295199 0.459542 H\n","nsites":20,"nelements":3,"elements":["Li","Be","H"],"chemical_system":"Be-H-Li","density":1.0091200331652015,"density_atomic":0.16011651591639225,"volume":124.9090381809417,"volume_molar":3.761099050609227,"formula_full":"Li4 Be4 H12","formula_reduced":"LiBeH3","formula_anonymous":"ABC3","energy_above_hull":2.14289522,"spacegroup":62},{"id":"jvasp-52899","created_at":"2022-09-04T14:36:14.270900Z","updated_at":"2022-09-04T14:36:14.270916Z","structure_string":"H8 O4\n1.0\n-2.349207 2.349207 3.389515\n2.349207 -2.349207 3.389515\n2.349207 2.349207 -3.389515\nH O\n8 4\ndirect\n0.802081 0.721514 0.419435 H\n0.721515 0.802081 0.919436 H\n0.382646 0.802081 0.580566 H\n0.802081 0.382646 0.080566 H\n0.197919 0.278486 0.580566 H\n0.278485 0.197919 0.080566 H\n0.617354 0.197919 0.419435 H\n0.197919 0.617354 0.919436 H\n0.889904 0.639904 0.250000 O\n0.639905 0.889905 0.750001 O\n0.110096 0.360096 0.750001 O\n0.360095 0.110095 0.250000 O\n","nsites":12,"nelements":2,"elements":["H","O"],"chemical_system":"H-O","density":1.5992265132554102,"density_atomic":0.1603766442699132,"volume":74.82386263054646,"volume_molar":3.754998608067122,"formula_full":"H8 O4","formula_reduced":"H2O","formula_anonymous":"AB2","energy_above_hull":1.9077478333333333,"spacegroup":141},{"id":"jvasp-112295","created_at":"2022-09-04T14:38:26.342520Z","updated_at":"2022-09-04T14:38:26.342545Z","structure_string":"Li4 H8 N4\n1.0\n3.967154 -0.000000 0.000000\n0.000000 4.629164 0.000000\n0.000000 -0.000000 5.430160\nLi H N\n4 8 4\ndirect\n0.250000 0.628553 0.120479 Li\n0.250000 0.128553 0.379521 Li\n0.749999 0.371446 0.879521 Li\n0.749999 0.871446 0.620479 Li\n0.250000 0.242996 0.822234 H\n0.250000 0.742995 0.677766 H\n0.749999 0.757004 0.177766 H\n0.749999 0.257004 0.322234 H\n0.000000 0.000000 0.000000 H\n0.500000 0.500000 0.500000 H\n0.500000 0.000000 -0.000000 H\n-0.000000 0.500000 0.500000 H\n0.250000 0.197715 0.008376 N\n0.250000 0.697715 0.491624 N\n0.749999 0.802284 -0.008376 N\n0.749999 0.302284 0.508376 N\n","nsites":16,"nelements":3,"elements":["Li","H","N"],"chemical_system":"H-Li-N","density":1.5295174318000042,"density_atomic":0.160444830855754,"volume":99.72275151939677,"volume_molar":3.7534027914019448,"formula_full":"Li4 H8 N4","formula_reduced":"LiH2N","formula_anonymous":"ABC2","energy_above_hull":2.6599483125,"spacegroup":62},{"id":"jvasp-7776","created_at":"2022-09-04T14:36:59.984953Z","updated_at":"2022-09-04T14:36:59.984978Z","structure_string":"B4 N4\n1.0\n4.421483 -0.000000 0.000000\n-0.000000 4.421483 0.000000\n0.000000 0.000000 2.549229\nB N\n4 4\ndirect\n0.174489 0.825510 0.500000 B\n0.325510 0.325510 0.000000 B\n0.674489 0.674489 0.000000 B\n0.825510 0.174489 0.500000 B\n0.812445 0.812445 0.500000 N\n0.312445 0.687554 0.000000 N\n0.687554 0.312445 0.000000 N\n0.187554 0.187554 0.500000 N\n","nsites":8,"nelements":2,"elements":["B","N"],"chemical_system":"B-N","density":3.3076979931859185,"density_atomic":0.16052593845053206,"volume":49.836182720497185,"volume_molar":3.751506341048922,"formula_full":"B4 N4","formula_reduced":"BN","formula_anonymous":"AB","energy_above_hull":2.5918079166666668,"spacegroup":136},{"id":"jvasp-52134","created_at":"2022-09-04T14:37:18.409247Z","updated_at":"2022-09-04T14:37:18.409268Z","structure_string":"H4 O2\n1.0\n3.404757 0.000000 0.000000\n0.000000 3.404757 0.000000\n0.000000 0.000000 3.224045\nH O\n4 2\ndirect\n0.334963 0.334963 0.324818 H\n0.665038 0.665038 0.324818 H\n0.834964 0.165037 0.824818 H\n0.165037 0.834964 0.824818 H\n0.000000 0.000000 0.010362 O\n0.500000 0.500000 0.510361 O\n","nsites":6,"nelements":2,"elements":["H","O"],"chemical_system":"H-O","density":1.6008357403841806,"density_atomic":0.16053802381473764,"volume":37.374323275114286,"volume_molar":3.7512239262080405,"formula_full":"H4 O2","formula_reduced":"H2O","formula_anonymous":"AB2","energy_above_hull":1.9091878333333328,"spacegroup":102},{"id":"jvasp-9110","created_at":"2022-09-04T14:36:43.409901Z","updated_at":"2022-09-04T14:36:43.409929Z","structure_string":"C6 N8\n1.0\n3.222671 -5.581831 0.000000\n3.222671 5.581831 -0.000000\n-0.000000 -0.000000 2.423288\nC N\n6 8\ndirect\n0.178435 0.773366 0.250000 C\n0.226634 0.405069 0.250000 C\n0.594931 0.821565 0.250000 C\n0.821565 0.226634 0.750001 C\n0.773366 0.594931 0.750001 C\n0.405069 0.178435 0.750001 C\n0.329892 0.033392 0.250000 N\n0.966608 0.296500 0.250000 N\n0.703499 0.670108 0.250000 N\n0.670108 0.966608 0.750001 N\n0.033392 0.703499 0.750001 N\n0.296500 0.329892 0.750001 N\n0.333333 0.666667 0.250000 N\n0.666667 0.333333 0.750001 N\n","nsites":14,"nelements":2,"elements":["C","N"],"chemical_system":"C-N","density":3.506850021890578,"density_atomic":0.1605832909619019,"volume":87.18217142106943,"volume_molar":3.750166486143781,"formula_full":"C6 N8","formula_reduced":"C3N4","formula_anonymous":"A3B4","energy_above_hull":6.380449,"spacegroup":176},{"id":"jvasp-120834","created_at":"2022-09-04T14:38:53.273738Z","updated_at":"2022-09-04T14:38:53.273760Z","structure_string":"B1 H1 N2\n1.0\n2.313686 -0.000000 0.000000\n0.000000 2.313686 0.000000\n0.000000 -0.000000 4.647130\nB H N\n1 1 2\ndirect\n0.500000 0.500000 0.535637 B\n0.000000 0.000000 0.197220 H\n0.000000 0.000000 0.420896 N\n0.500000 0.500000 0.856248 N\n","nsites":4,"nelements":3,"elements":["B","H","N"],"chemical_system":"B-H-N","density":2.658834214161658,"density_atomic":0.160792701616012,"volume":24.876750995529473,"volume_molar":3.745282403663716,"formula_full":"B1 H1 N2","formula_reduced":"BHN2","formula_anonymous":"ABC2","energy_above_hull":4.482807270833333,"spacegroup":99},{"id":"jvasp-45375","created_at":"2022-09-04T14:37:15.160531Z","updated_at":"2022-09-04T14:37:15.160549Z","structure_string":"C12 N16\n1.0\n3.253822 -5.635785 0.000000\n3.253822 5.635785 0.000000\n-0.000000 -0.000000 4.740348\nC N\n12 16\ndirect\n0.919252 0.482918 0.796014 C\n0.911035 0.165864 0.506935 C\n0.254829 0.088964 0.506935 C\n0.165864 0.911035 0.006935 C\n0.088964 0.254829 0.006935 C\n0.745170 0.834134 0.006935 C\n0.834134 0.745170 0.506935 C\n0.080747 0.563666 0.296014 C\n0.482918 0.919252 0.296014 C\n0.517081 0.436333 0.796014 C\n0.563666 0.080747 0.796014 C\n0.436333 0.517081 0.296014 C\n0.949727 0.603043 0.526791 N\n0.685525 0.680253 0.254619 N\n0.314473 0.994727 0.754619 N\n0.005273 0.319747 0.754619 N\n0.680253 0.685525 0.754619 N\n0.396956 0.346683 0.526791 N\n0.653316 0.050272 0.526791 N\n0.000000 0.000000 0.506547 N\n0.603043 0.949727 0.026791 N\n0.050272 0.653316 0.026791 N\n0.666667 0.333332 0.871777 N\n0.333332 0.666667 0.371776 N\n0.319747 0.005273 0.254619 N\n0.000000 0.000000 0.006547 N\n0.346683 0.396956 0.026791 N\n0.994727 0.314473 0.254619 N\n","nsites":28,"nelements":2,"elements":["C","N"],"chemical_system":"C-N","density":3.5171139646370824,"density_atomic":0.1610532904469639,"volume":173.85549790564892,"volume_molar":3.7392224295989394,"formula_full":"C12 N16","formula_reduced":"C3N4","formula_anonymous":"A3B4","energy_above_hull":6.374977571428571,"spacegroup":159},{"id":"jvasp-3315","created_at":"2022-09-04T14:36:03.243919Z","updated_at":"2022-09-04T14:36:03.243946Z","structure_string":"Be2 C2 N4\n1.0\n3.427982 0.000000 -1.557848\n-0.707964 3.354078 -1.557848\n-0.071411 -0.088057 4.393356\nBe C N\n2 2 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250001 0.750000 0.500000 Be\n0.500000 0.500000 -0.000000 C\n0.750000 0.250000 0.500000 C\n0.420445 0.375000 0.250000 N\n0.125001 0.579555 0.750000 N\n0.625000 0.170444 0.750000 N\n0.829556 0.875000 0.250000 N\n","nsites":8,"nelements":3,"elements":["Be","C","N"],"chemical_system":"Be-C-N","density":3.2851165514231555,"density_atomic":0.16137793067192782,"volume":49.573073385502425,"volume_molar":3.731700322916317,"formula_full":"Be2 C2 N4","formula_reduced":"BeCN2","formula_anonymous":"ABC2","energy_above_hull":4.40843065,"spacegroup":122},{"id":"jvasp-79487","created_at":"2022-09-04T14:37:16.200615Z","updated_at":"2022-09-04T14:37:16.200646Z","structure_string":"H3 S1\n1.0\n-1.835747 -1.835747 1.835747\n-1.835747 1.835747 -1.835747\n1.835747 -1.835747 -1.835747\nH S\n3 1\ndirect\n0.000000 0.500001 0.500001 H\n0.500001 0.000000 0.500001 H\n0.500001 0.500001 0.000000 H\n0.000000 0.000000 0.000000 S\n","nsites":4,"nelements":2,"elements":["H","S"],"chemical_system":"H-S","density":2.354612191173461,"density_atomic":0.1616447182362798,"volume":24.745627593925512,"volume_molar":3.7255413141289893,"formula_full":"H3 S1","formula_reduced":"H3S","formula_anonymous":"AB3","energy_above_hull":2.58365,"spacegroup":229},{"id":"jvasp-93685","created_at":"2022-09-04T14:35:52.592602Z","updated_at":"2022-09-04T14:35:52.592631Z","structure_string":"C2 N4\n1.0\n2.477183 0.000000 -0.000000\n-1.238591 3.223090 -0.000000\n-0.000000 -0.000000 4.581420\nC N\n2 4\ndirect\n0.887369 0.774738 0.279273 C\n0.112630 0.225262 0.779273 C\n0.924779 0.849560 0.952032 N\n0.075220 0.150440 0.452032 N\n0.736907 0.473815 0.821545 N\n0.263092 0.526185 0.321546 N\n","nsites":6,"nelements":2,"elements":["C","N"],"chemical_system":"C-N","density":3.633875442743284,"density_atomic":0.16402899324209602,"volume":36.578899140985364,"volume_molar":3.671387991214283,"formula_full":"C2 N4","formula_reduced":"CN2","formula_anonymous":"AB2","energy_above_hull":5.130458833333333,"spacegroup":36},{"id":"jvasp-117474","created_at":"2022-09-04T14:38:50.070356Z","updated_at":"2022-09-04T14:38:50.070376Z","structure_string":"B2 H1\n1.0\n3.910231 0.837126 -0.302289\n-3.809547 -4.165696 0.657711\n-0.669166 0.755235 -1.441237\nB H\n2 1\ndirect\n0.584426 0.327491 0.182213 B\n0.416714 0.938062 0.403653 B\n0.000620 0.132801 0.792966 H\n","nsites":3,"nelements":2,"elements":["B","H"],"chemical_system":"B-H","density":2.0555180441605003,"density_atomic":0.16410055441064642,"volume":18.281473885169078,"volume_molar":3.669786967891742,"formula_full":"B2 H1","formula_reduced":"B2H","formula_anonymous":"AB2","energy_above_hull":3.545338388888889,"spacegroup":71}]}