{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=density&page=26","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=density&page=24","results":[{"id":"jvasp-114282","created_at":"2022-09-04T14:38:40.356006Z","updated_at":"2022-09-04T14:38:40.356027Z","structure_string":"Ga1 N1 O1\n1.0\n6.350127 -0.000000 0.000000\n-0.000000 6.350127 0.000000\n0.000000 0.000000 4.762595\nGa N O\n1 1 1\ndirect\n0.321684 -0.027610 0.000000 Ga\n-0.093871 -0.191640 0.000000 N\n0.018873 0.364386 0.000000 O\n","nsites":3,"nelements":3,"elements":["Ga","N","O"],"chemical_system":"Ga-N-O","density":0.8623082146791433,"density_atomic":0.015621142021024966,"volume":192.04741855379137,"volume_molar":38.55121957085225,"formula_full":"Ga1 N1 O1","formula_reduced":"GaNO","formula_anonymous":"ABC","energy_above_hull":3.0260796916666663,"spacegroup":6},{"id":"jvasp-76813","created_at":"2022-09-04T14:37:13.707622Z","updated_at":"2022-09-04T14:37:13.707642Z","structure_string":"Zn1 Ni1 Pd2\n1.0\n-8.250823 0.000000 -4.763614\n-8.373460 0.007471 4.976030\n-5.544948 8.007709 0.076904\nZn Ni Pd\n1 1 2\ndirect\n0.500000 0.000000 -0.000000 Zn\n0.000000 0.000000 0.000000 Ni\n0.758028 0.000000 -0.000000 Pd\n0.241971 0.000000 -0.000000 Pd\n","nsites":4,"nelements":3,"elements":["Zn","Ni","Pd"],"chemical_system":"Ni-Pd-Zn","density":0.8634670440262536,"density_atomic":0.006173067067301945,"volume":647.9761124235242,"volume_molar":97.55508395330119,"formula_full":"Zn1 Ni1 Pd2","formula_reduced":"ZnNiPd2","formula_anonymous":"ABC2","energy_above_hull":1.23048105,"spacegroup":71},{"id":"jvasp-101988","created_at":"2022-09-04T14:36:30.894880Z","updated_at":"2022-09-04T14:36:30.894909Z","structure_string":"H8 C8\n1.0\n5.843971 0.000000 0.000000\n0.000000 5.843971 -0.000000\n0.000000 0.000000 5.843971\nH C\n8 8\ndirect\n0.165307 0.165307 0.165307 H\n0.834693 0.834693 0.834693 H\n0.334693 0.834693 0.665307 H\n0.665307 0.165307 0.334693 H\n0.834693 0.665307 0.334693 H\n0.165307 0.334693 0.665307 H\n0.665307 0.334693 0.834693 H\n0.334693 0.665307 0.165307 H\n0.059596 0.059596 0.059596 C\n0.940404 0.940404 0.940404 C\n0.440404 0.940404 0.559596 C\n0.559596 0.059596 0.440404 C\n0.940404 0.559596 0.440404 C\n0.059596 0.440404 0.559596 C\n0.559596 0.440404 0.940404 C\n0.440404 0.559596 0.059596 C\n","nsites":16,"nelements":2,"elements":["H","C"],"chemical_system":"C-H","density":0.8665239002616685,"density_atomic":0.08016703589750253,"volume":199.58328034551235,"volume_molar":7.511991297395105,"formula_full":"H8 C8","formula_reduced":"HC","formula_anonymous":"AB","energy_above_hull":3.13724,"spacegroup":205},{"id":"jvasp-80606","created_at":"2022-09-04T14:37:17.424436Z","updated_at":"2022-09-04T14:37:17.424470Z","structure_string":"Be2 Cu1 Os1\n1.0\n-7.363108 0.000000 -4.251092\n-7.693165 -0.002367 4.822768\n-5.017642 7.565155 0.188627\nBe Cu Os\n2 1 1\ndirect\n0.748807 0.000000 0.000000 Be\n0.251193 0.000000 0.000000 Be\n0.000000 0.000000 0.000000 Cu\n0.500000 0.000000 0.000000 Os\n","nsites":4,"nelements":3,"elements":["Be","Cu","Os"],"chemical_system":"Be-Cu-Os","density":0.8744937539670697,"density_atomic":0.0077502831923366095,"volume":516.1101731037588,"volume_molar":77.70220275247004,"formula_full":"Be2 Cu1 Os1","formula_reduced":"Be2CuOs","formula_anonymous":"ABC2","energy_above_hull":3.0304744125,"spacegroup":71},{"id":"jvasp-32740","created_at":"2022-09-04T14:36:48.152841Z","updated_at":"2022-09-04T14:36:48.152865Z","structure_string":"B4 H32 C4 N4\n1.0\n4.900170 0.000000 0.000000\n-0.000000 6.449533 0.000000\n0.000000 0.000000 10.741604\nB H C N\n4 32 4 4\ndirect\n0.816784 0.250000 0.470598 B\n0.683216 0.250000 0.970597 B\n0.183216 0.750000 0.529402 B\n0.316784 0.750000 0.029402 B\n0.120859 0.250000 0.762345 H\n0.316039 0.750000 0.915446 H\n0.226059 0.121982 0.461202 H\n0.794120 0.404723 0.927823 H\n0.294120 0.904723 0.572176 H\n0.205880 0.904723 0.072177 H\n0.816039 0.250000 0.584554 H\n0.205880 0.595277 0.072177 H\n0.705880 0.095277 0.427823 H\n0.794120 0.095277 0.927823 H\n0.437392 0.111718 0.748585 H\n0.937392 0.888282 0.751414 H\n0.726059 0.621982 0.038798 H\n0.726059 0.878017 0.038798 H\n0.273941 0.121982 0.961201 H\n0.273941 0.378017 0.961201 H\n0.773941 0.621982 0.538798 H\n0.062608 0.388282 0.248586 H\n0.294120 0.595277 0.572176 H\n0.379141 0.250000 0.262345 H\n0.226059 0.378017 0.461202 H\n0.562608 0.611717 0.251414 H\n0.937392 0.611717 0.751414 H\n0.183961 0.750000 0.415446 H\n0.620859 0.750000 0.737654 H\n0.562608 0.888282 0.251414 H\n0.879141 0.750000 0.237655 H\n0.773941 0.878017 0.538798 H\n0.437392 0.388282 0.748585 H\n0.705880 0.404723 0.427823 H\n0.683961 0.250000 0.084554 H\n0.062608 0.111718 0.248586 H\n0.838356 0.750000 0.712818 C\n0.661644 0.750000 0.212818 C\n0.338356 0.250000 0.787182 C\n0.161644 0.250000 0.287182 C\n0.627127 0.750000 0.075438 N\n0.127127 0.250000 0.424562 N\n0.872873 0.750000 0.575438 N\n0.372873 0.250000 0.924562 N\n","nsites":44,"nelements":4,"elements":["B","H","C","N"],"chemical_system":"B-C-H-N","density":0.8783522438971822,"density_atomic":0.12961167480879646,"volume":339.4755917235769,"volume_molar":4.6462949953265245,"formula_full":"B4 H32 C4 N4","formula_reduced":"BH8CN","formula_anonymous":"ABCD8","energy_above_hull":3.967564166666667,"spacegroup":62},{"id":"jvasp-112206","created_at":"2022-09-04T14:38:46.603582Z","updated_at":"2022-09-04T14:38:46.603609Z","structure_string":"H32 C12\n1.0\n3.481593 0.000000 -2.007996\n0.000000 12.373780 0.000000\n0.001553 0.000000 7.705357\nH C\n32 12\ndirect\n0.745553 0.051226 0.690196 H\n0.364954 0.227572 0.219623 H\n0.635044 0.772428 0.780376 H\n0.635044 0.727572 0.280376 H\n0.364954 0.272428 0.719623 H\n0.672681 0.203881 0.479340 H\n0.327317 0.796119 0.520659 H\n0.327317 0.703881 0.020659 H\n0.672681 0.296119 0.979340 H\n0.867868 0.244141 0.327245 H\n0.132130 0.755859 0.672754 H\n0.867868 0.255859 0.827245 H\n0.846770 0.402181 0.530892 H\n0.153229 0.597819 0.469108 H\n0.153228 0.902181 0.969108 H\n0.846770 0.097819 0.030892 H\n0.132131 0.744141 0.172754 H\n0.649071 0.617216 0.570155 H\n0.254445 0.948774 0.309804 H\n0.350927 0.382784 0.429845 H\n0.745554 0.448774 0.190196 H\n0.248627 0.079362 0.580620 H\n0.751371 0.920638 0.419379 H\n0.751370 0.579362 0.919379 H\n0.248628 0.420638 0.080620 H\n0.254445 0.551226 0.809804 H\n0.548273 0.032193 0.254345 H\n0.548272 0.467807 0.754345 H\n0.451726 0.532193 0.245655 H\n0.350927 0.117216 0.929845 H\n0.649071 0.882784 0.070154 H\n0.451726 0.967807 0.745655 H\n0.374315 0.756067 0.146127 C\n0.625684 0.243933 0.853872 C\n0.584626 0.374862 0.395352 C\n0.415372 0.625138 0.604648 C\n0.415373 0.874862 0.104648 C\n0.496563 0.551639 0.781279 C\n0.503435 0.448361 0.218720 C\n0.496564 0.948361 0.281279 C\n0.503434 0.051639 0.718720 C\n0.374314 0.743933 0.646127 C\n0.584626 0.125138 0.895352 C\n0.625684 0.256067 0.353872 C\n","nsites":44,"nelements":2,"elements":["H","C"],"chemical_system":"C-H","density":0.8822281397807851,"density_atomic":0.1325345294211025,"volume":331.9889555739744,"volume_molar":4.543827775526957,"formula_full":"H32 C12","formula_reduced":"H8C3","formula_anonymous":"A3B8","energy_above_hull":4.238830909090909,"spacegroup":14},{"id":"jvasp-115830","created_at":"2022-09-04T14:38:39.880989Z","updated_at":"2022-09-04T14:38:39.881022Z","structure_string":"Rb1 Ag1 S1\n1.0\n7.107321 0.000000 0.000000\n0.000000 7.107321 0.000000\n0.000000 0.000000 8.368401\nRb Ag S\n1 1 1\ndirect\n0.000000 -0.000000 0.666580 Rb\n0.000000 -0.000000 0.277853 Ag\n0.000000 -0.000000 0.006993 S\n","nsites":3,"nelements":3,"elements":["Rb","Ag","S"],"chemical_system":"Ag-Rb-S","density":0.8854225775070123,"density_atomic":0.007096870993037179,"volume":422.7215068363697,"volume_molar":84.85628054826402,"formula_full":"Rb1 Ag1 S1","formula_reduced":"RbAgS","formula_anonymous":"ABC","energy_above_hull":0.5989993911111111,"spacegroup":99},{"id":"jvasp-105707","created_at":"2022-09-04T14:35:41.093186Z","updated_at":"2022-09-04T14:35:41.093216Z","structure_string":"K2\n1.0\n4.206719 0.044601 -7.316262\n-0.261348 4.198830 -7.316262\n-0.041468 -0.044601 8.439340\nK\n2\ndirect\n0.250000 0.750000 0.500000 K\n0.500000 0.500000 0.000000 K\n","nsites":2,"nelements":1,"elements":["K"],"chemical_system":"K","density":0.8866610920725901,"density_atomic":0.013656854402165079,"volume":146.4466077695704,"volume_molar":44.09610429064313,"formula_full":"K2","formula_reduced":"K","formula_anonymous":"A","energy_above_hull":0.0617399999999999,"spacegroup":141},{"id":"jvasp-90674","created_at":"2022-09-04T14:36:06.433590Z","updated_at":"2022-09-04T14:36:06.433608Z","structure_string":"K8\n1.0\n0.000000 -4.503570 0.000000\n-11.450892 0.000000 0.000000\n0.000000 0.000000 -11.349832\nK\n8\ndirect\n0.750000 0.493428 0.681397 K\n0.750000 0.993427 0.818603 K\n0.250000 0.506572 0.318603 K\n0.250000 0.006572 0.181397 K\n0.750000 0.318410 0.022419 K\n0.750000 0.818410 0.477581 K\n0.250000 0.681589 0.977581 K\n0.250000 0.181589 0.522419 K\n","nsites":8,"nelements":1,"elements":["K"],"chemical_system":"K","density":0.8873833787378461,"density_atomic":0.013667979468903902,"volume":585.3096295762549,"volume_molar":44.06021221864582,"formula_full":"K8","formula_reduced":"K","formula_anonymous":"A","energy_above_hull":0.0345499999999998,"spacegroup":62},{"id":"jvasp-81634","created_at":"2022-09-04T14:37:19.093903Z","updated_at":"2022-09-04T14:37:19.093921Z","structure_string":"Si2 Tc1 Ir1\n1.0\n-7.940097 0.000012 -4.584198\n-8.293035 -0.003468 5.195501\n-5.409415 8.152640 0.200927\nSi Tc Ir\n2 1 1\ndirect\n0.746290 0.000000 -0.000000 Si\n0.253710 -0.000000 -0.000000 Si\n0.000000 0.000000 0.000000 Tc\n0.500000 0.000000 -0.000000 Ir\n","nsites":4,"nelements":3,"elements":["Si","Tc","Ir"],"chemical_system":"Ir-Si-Tc","density":0.8899081466682787,"density_atomic":0.006188611758558733,"volume":646.3485117592124,"volume_molar":97.31004294576232,"formula_full":"Si2 Tc1 Ir1","formula_reduced":"Si2TcIr","formula_anonymous":"ABC2","energy_above_hull":4.80850245,"spacegroup":71},{"id":"jvasp-118082","created_at":"2022-09-04T14:38:52.535665Z","updated_at":"2022-09-04T14:38:52.535690Z","structure_string":"S1 N1 Cl1\n1.0\n4.233418 0.000000 0.000000\n0.000000 4.233418 0.000000\n0.000000 0.000000 8.466836\nS N Cl\n1 1 1\ndirect\n0.000000 0.000000 0.780247 S\n0.000000 0.000000 0.024351 N\n0.000000 0.000000 0.203154 Cl\n","nsites":3,"nelements":3,"elements":["S","N","Cl"],"chemical_system":"Cl-N-S","density":0.8921437863209774,"density_atomic":0.019770506832558536,"volume":151.74117818059824,"volume_molar":30.460224469726775,"formula_full":"S1 N1 Cl1","formula_reduced":"SNCl","formula_anonymous":"ABC","energy_above_hull":2.827939105833333,"spacegroup":99},{"id":"jvasp-118462","created_at":"2022-09-04T14:38:52.994062Z","updated_at":"2022-09-04T14:38:52.994098Z","structure_string":"Na1 Li1 H1\n1.0\n4.419405 -0.000000 -0.000000\n-2.209702 3.827317 0.000000\n0.000000 -0.000000 3.398882\nNa Li H\n1 1 1\ndirect\n0.666666 0.333334 0.000000 Na\n0.333334 0.666668 0.000000 Li\n0.000000 0.000000 0.000000 H\n","nsites":3,"nelements":3,"elements":["Na","Li","H"],"chemical_system":"H-Li-Na","density":0.8936284044366072,"density_atomic":0.05218274613663399,"volume":57.49026684308402,"volume_molar":11.540482641967095,"formula_full":"Na1 Li1 H1","formula_reduced":"NaLiH","formula_anonymous":"ABC","energy_above_hull":0.8826163333333333,"spacegroup":187}]}