{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-spacegroup&page=3549","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-spacegroup&page=3547","results":[{"id":"jvasp-30325","created_at":"2022-09-04T14:38:02.112093Z","updated_at":"2022-09-04T14:38:02.112103Z","structure_string":"Sb4 P4 O16\n1.0\n6.804726 0.000000 0.000000\n0.000000 9.415235 0.000000\n-0.000000 0.000000 5.074818\nSb P O\n4 4 16\ndirect\n0.250000 0.338574 0.679331 Sb\n0.250000 0.838573 0.820669 Sb\n0.750000 0.161426 0.179331 Sb\n0.750000 0.661426 0.320669 Sb\n0.250000 0.108487 0.203725 P\n0.250000 0.608487 0.296275 P\n0.750000 0.391513 0.703725 P\n0.750000 0.891513 0.796276 P\n0.750000 0.856874 0.494084 O\n0.750000 0.356874 0.005916 O\n0.750000 0.056149 0.810456 O\n0.750000 0.556148 0.689545 O\n0.568487 0.328175 0.564973 O\n0.568487 0.828175 0.935028 O\n0.431514 0.671824 0.435027 O\n0.250000 0.443851 0.310456 O\n0.250000 0.643126 -0.005916 O\n0.250000 0.943851 0.189544 O\n0.931514 0.328175 0.564973 O\n0.250000 0.143126 0.505916 O\n0.068487 0.671824 0.435027 O\n0.068487 0.171824 0.064973 O\n0.431514 0.171824 0.064973 O\n0.931514 0.828175 0.935028 O\n","nsites":24,"nelements":3,"elements":["Sb","P","O"],"chemical_system":"O-P-Sb","density":4.427601955631829,"density_atomic":0.07381573751734334,"volume":325.13391868991476,"volume_molar":8.158342600837758,"formula_full":"Sb4 P4 O16","formula_reduced":"SbPO4","formula_anonymous":"ABC4","energy_above_hull":2.3008692666666675,"spacegroup":62},{"id":"jvasp-4285","created_at":"2022-09-04T14:38:02.159002Z","updated_at":"2022-09-04T14:38:02.159019Z","structure_string":"Sb8 S12\n1.0\n3.889911 0.000000 0.000000\n0.000000 11.199032 0.000000\n0.000000 0.000000 11.472339\nSb S\n8 12\ndirect\n0.750000 0.964672 0.349747 Sb\n0.250000 0.035328 0.650253 Sb\n0.250000 0.464672 0.150253 Sb\n0.750000 0.535328 0.849747 Sb\n0.250000 0.673232 0.474348 Sb\n0.750000 0.326768 0.525653 Sb\n0.750000 0.173232 0.025652 Sb\n0.250000 0.826768 0.974348 Sb\n0.750000 0.307923 0.207929 S\n0.250000 0.692076 0.792071 S\n0.750000 0.625150 0.049795 S\n0.250000 0.374849 0.950205 S\n0.250000 0.125150 0.450205 S\n0.250000 0.440665 0.624157 S\n0.750000 0.940664 0.875843 S\n0.250000 0.059335 0.124157 S\n0.750000 0.192077 0.707929 S\n0.750000 0.559335 0.375843 S\n0.750000 0.874849 0.549795 S\n0.250000 0.807923 0.292071 S\n","nsites":20,"nelements":2,"elements":["Sb","S"],"chemical_system":"S-Sb","density":4.514936952093696,"density_atomic":0.04001822977706276,"volume":499.7722315908985,"volume_molar":15.048493632898548,"formula_full":"Sb8 S12","formula_reduced":"Sb2S3","formula_anonymous":"A2B3","energy_above_hull":1.83011044,"spacegroup":62},{"id":"jvasp-54967","created_at":"2022-09-04T14:38:02.273100Z","updated_at":"2022-09-04T14:38:02.273122Z","structure_string":"Rb4 Yb4 Br12\n1.0\n7.645503 0.000000 0.000000\n-0.000000 7.963696 0.000000\n0.000000 0.000000 11.086886\nYb Rb Br\n4 4 12\ndirect\n0.500000 0.000000 0.500000 Yb\n0.500000 0.000000 0.000000 Yb\n0.000000 0.500000 0.500000 Yb\n0.000000 0.500000 0.000000 Yb\n0.479411 0.565953 0.750000 Rb\n0.520588 0.434048 0.250000 Rb\n0.979411 0.934048 0.250000 Rb\n0.020589 0.065952 0.750000 Rb\n0.803466 0.200484 0.460041 Br\n0.696533 0.700484 0.460041 Br\n0.196533 0.799517 0.539959 Br\n0.920581 0.489042 0.750000 Br\n0.803466 0.200484 0.039959 Br\n0.420581 0.010958 0.250000 Br\n0.079419 0.510958 0.250000 Br\n0.579419 0.989043 0.750000 Br\n0.303466 0.299517 0.539959 Br\n0.303466 0.299517 0.960041 Br\n0.696533 0.700484 0.039959 Br\n0.196533 0.799517 0.960041 Br\n","nsites":20,"nelements":3,"elements":["Yb","Rb","Br"],"chemical_system":"Br-Rb-Yb","density":4.902298519891067,"density_atomic":0.029627818629976124,"volume":675.0412593576795,"volume_molar":20.325967413298066,"formula_full":"Rb4 Yb4 Br12","formula_reduced":"RbYbBr3","formula_anonymous":"ABC3","energy_above_hull":0.0,"spacegroup":62},{"id":"jvasp-46771","created_at":"2022-09-04T14:38:02.460946Z","updated_at":"2022-09-04T14:38:02.460968Z","structure_string":"Li4 Mn8 O4 F12\n1.0\n5.176028 0.000000 0.000000\n-0.000000 6.285551 0.000000\n0.000000 0.000000 10.598281\nLi Mn O F\n4 8 4 12\ndirect\n0.520511 0.750000 0.089317 Li\n0.020511 0.250000 0.410683 Li\n0.979489 0.750000 0.589317 Li\n0.479489 0.250000 0.910683 Li\n0.000000 0.000000 0.000000 Mn\n0.000000 0.500000 0.000000 Mn\n0.507735 0.250000 0.239091 Mn\n0.007735 0.750000 0.260909 Mn\n0.500000 0.000000 0.500000 Mn\n0.500000 0.500000 0.500000 Mn\n0.992266 0.250000 0.739091 Mn\n0.492265 0.750000 0.760909 Mn\n0.837362 0.250000 0.915743 O\n0.337362 0.750000 0.584256 O\n0.662639 0.250000 0.415743 O\n0.162639 0.750000 0.084257 O\n0.294806 0.250000 0.069888 F\n0.711481 0.523455 0.168243 F\n0.711481 0.976544 0.168243 F\n0.211481 0.023455 0.331757 F\n0.211481 0.476544 0.331757 F\n0.794806 0.750000 0.430112 F\n0.205194 0.250000 0.569888 F\n0.788520 0.976544 0.668243 F\n0.788520 0.523455 0.668243 F\n0.288519 0.476544 0.831757 F\n0.288519 0.023455 0.831757 F\n0.705194 0.750000 0.930112 F\n","nsites":28,"nelements":4,"elements":["Li","Mn","O","F"],"chemical_system":"F-Li-Mn-O","density":3.656424961301214,"density_atomic":0.08120497363725232,"volume":344.8064662280139,"volume_molar":7.415975266368879,"formula_full":"Li4 Mn8 O4 F12","formula_reduced":"LiMn2OF3","formula_anonymous":"ABC2D3","energy_above_hull":1.4918741186083746,"spacegroup":62},{"id":"jvasp-46099","created_at":"2022-09-04T14:38:02.491789Z","updated_at":"2022-09-04T14:38:02.491820Z","structure_string":"Mg4 Sn4 O12\n1.0\n5.316359 -0.000000 0.000000\n0.000000 5.437297 0.000000\n0.000000 0.000000 7.816916\nMg Sn O\n4 4 12\ndirect\n0.998066 0.958152 0.750000 Mg\n0.501935 0.458152 0.750000 Mg\n0.498066 0.541848 0.250000 Mg\n0.001935 0.041848 0.250000 Mg\n0.000000 0.500000 0.000000 Sn\n0.000000 0.500000 0.500000 Sn\n0.500000 0.000000 0.500000 Sn\n0.500000 0.000000 0.000000 Sn\n0.830162 0.824719 0.071954 O\n0.669838 0.324719 0.428046 O\n0.669838 0.324719 0.071954 O\n0.635294 0.088538 0.750000 O\n0.364706 0.911462 0.250000 O\n0.169838 0.175281 0.571955 O\n0.330162 0.675282 0.571955 O\n0.169838 0.175281 0.928046 O\n0.830162 0.824719 0.428046 O\n0.135294 0.411462 0.250000 O\n0.330162 0.675282 0.928046 O\n0.864707 0.588538 0.750000 O\n","nsites":20,"nelements":3,"elements":["Mg","Sn","O"],"chemical_system":"Mg-O-Sn","density":5.614869513404082,"density_atomic":0.08851098921550271,"volume":225.9606425966483,"volume_molar":6.80383397968534,"formula_full":"Mg4 Sn4 O12","formula_reduced":"MgSnO3","formula_anonymous":"ABC3","energy_above_hull":1.00405625,"spacegroup":62},{"id":"jvasp-40672","created_at":"2022-09-04T14:38:02.650852Z","updated_at":"2022-09-04T14:38:02.650873Z","structure_string":"Li4 Mn4 P4 O16\n1.0\n5.004806 -0.000000 0.000000\n0.000000 6.328723 0.000000\n0.000000 0.000000 9.336023\nLi Mn P O\n4 4 4 16\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.500000 0.000000 Li\n0.500000 0.000000 0.500000 Li\n0.500000 0.500000 0.500000 Li\n0.527097 0.250000 0.146795 Mn\n0.027096 0.750000 0.353205 Mn\n0.972905 0.250000 0.646795 Mn\n0.472904 0.750000 0.853205 Mn\n0.460058 0.250000 0.820081 P\n0.960058 0.750000 0.679918 P\n0.039943 0.250000 0.320081 P\n0.539943 0.750000 0.179918 P\n0.328587 0.447386 0.889031 O\n0.894957 0.750000 0.844041 O\n0.394957 0.250000 0.655959 O\n0.828587 0.552614 0.610969 O\n0.828587 0.947385 0.610969 O\n0.265397 0.750000 0.651526 O\n0.734603 0.250000 0.348474 O\n0.671414 0.947385 0.110970 O\n0.171413 0.052614 0.389030 O\n0.605044 0.750000 0.344041 O\n0.105043 0.250000 0.155959 O\n0.671414 0.552614 0.110970 O\n0.328587 0.052614 0.889031 O\n0.234603 0.750000 0.151526 O\n0.171413 0.447386 0.389030 O\n0.765398 0.250000 0.848474 O\n","nsites":28,"nelements":4,"elements":["Li","Mn","P","O"],"chemical_system":"Li-Mn-O-P","density":3.5231366683111647,"density_atomic":0.09468752898061362,"volume":295.7094804505114,"volume_molar":6.360014697640886,"formula_full":"Li4 Mn4 P4 O16","formula_reduced":"LiMnPO4","formula_anonymous":"ABCD4","energy_above_hull":2.550815248768473,"spacegroup":62},{"id":"jvasp-55961","created_at":"2022-09-04T14:38:02.845012Z","updated_at":"2022-09-04T14:38:02.845032Z","structure_string":"As16 S12\n1.0\n7.995687 -0.000000 0.000000\n-0.000000 9.054419 0.000000\n0.000000 0.000000 10.274813\nAs S\n16 12\ndirect\n0.090602 0.141745 0.277172 As\n0.750000 0.659391 0.440331 As\n0.250000 0.340609 0.559669 As\n0.250000 0.840609 0.940331 As\n0.750000 0.031719 0.574306 As\n0.250000 0.968281 0.425693 As\n0.750000 0.531719 0.925693 As\n0.250000 0.468281 0.074307 As\n0.750000 0.159391 0.059669 As\n0.409398 0.141745 0.277172 As\n0.590603 0.358255 0.777172 As\n0.090602 0.641745 0.222828 As\n0.909398 0.358255 0.777172 As\n0.409398 0.641745 0.222828 As\n0.590603 0.858255 0.722828 As\n0.909398 0.858255 0.722828 As\n0.535602 0.167814 0.912215 S\n0.035602 0.832186 0.087785 S\n0.035602 0.332186 0.412215 S\n0.535602 0.667814 0.587785 S\n0.464398 0.832186 0.087785 S\n0.250000 0.095250 0.613942 S\n0.750000 0.904750 0.386057 S\n0.750000 0.404750 0.113943 S\n0.250000 0.595250 0.886057 S\n0.464398 0.332186 0.412215 S\n0.964399 0.167814 0.912215 S\n0.964399 0.667814 0.587785 S\n","nsites":28,"nelements":2,"elements":["As","S"],"chemical_system":"As-S","density":3.534954978358469,"density_atomic":0.03764157024580061,"volume":743.8584473803601,"volume_molar":15.998643841569935,"formula_full":"As16 S12","formula_reduced":"As4S3","formula_anonymous":"A3B4","energy_above_hull":2.422713857142857,"spacegroup":62},{"id":"jvasp-46362","created_at":"2022-09-04T14:38:02.712189Z","updated_at":"2022-09-04T14:38:02.712218Z","structure_string":"Mg4 Co4 O12\n1.0\n0.000000 5.121338 -0.000687\n4.883812 0.000000 0.000000\n0.000000 -0.000933 -7.158146\nMg Co O\n4 4 12\ndirect\n0.928180 0.020004 0.250001 Mg\n0.428180 0.479996 0.250001 Mg\n0.571821 0.520004 0.750000 Mg\n0.071821 0.979996 0.750000 Mg\n0.500000 0.000000 0.000000 Co\n0.500000 0.000000 0.500000 Co\n0.000000 0.500000 0.500000 Co\n0.000000 0.500000 0.000000 Co\n0.808034 0.815035 0.933225 O\n0.308035 0.684964 0.566775 O\n0.308034 0.684965 0.933225 O\n0.053955 0.630204 0.250000 O\n0.946046 0.369796 0.750001 O\n0.191966 0.184964 0.433226 O\n0.691966 0.315036 0.433226 O\n0.191967 0.184965 0.066776 O\n0.808035 0.815036 0.566775 O\n0.446046 0.130204 0.750001 O\n0.691967 0.315035 0.066776 O\n0.553955 0.869795 0.250000 O\n","nsites":20,"nelements":3,"elements":["Mg","Co","O"],"chemical_system":"Co-Mg-O","density":4.868783283484784,"density_atomic":0.11170871568520643,"volume":179.03705970767504,"volume_molar":5.390931874080718,"formula_full":"Mg4 Co4 O12","formula_reduced":"MgCoO3","formula_anonymous":"ABC3","energy_above_hull":1.6989480899999998,"spacegroup":62},{"id":"jvasp-49923","created_at":"2022-09-04T14:38:03.106551Z","updated_at":"2022-09-04T14:38:03.106568Z","structure_string":"Sm4 Tl4 O12\n1.0\n5.681136 0.000000 0.000000\n0.000000 6.079097 0.000000\n0.000000 0.000000 8.572873\nSm Tl O\n4 4 12\ndirect\n0.973489 0.070067 0.250000 Sm\n0.473489 0.429933 0.750000 Sm\n0.526512 0.570067 0.250000 Sm\n0.026512 0.929934 0.750000 Sm\n0.500000 0.000000 0.000000 Tl\n0.500000 0.000000 0.500000 Tl\n0.000000 0.500000 0.000000 Tl\n0.000000 0.500000 0.500000 Tl\n0.810658 0.812069 0.080936 O\n0.310658 0.687932 0.580936 O\n0.310658 0.687932 0.919063 O\n0.843889 0.577523 0.750000 O\n0.156112 0.422478 0.250000 O\n0.189343 0.187932 0.580936 O\n0.689343 0.312069 0.419064 O\n0.189343 0.187932 0.919063 O\n0.810658 0.812069 0.419064 O\n0.656112 0.077523 0.750000 O\n0.689343 0.312069 0.080936 O\n0.343889 0.922478 0.250000 O\n","nsites":20,"nelements":3,"elements":["Sm","Tl","O"],"chemical_system":"O-Sm-Tl","density":9.035138679199804,"density_atomic":0.06755062109450471,"volume":296.0742577336126,"volume_molar":8.91500427742167,"formula_full":"Sm4 Tl4 O12","formula_reduced":"SmTlO3","formula_anonymous":"ABC3","energy_above_hull":1.2943663949999995,"spacegroup":62},{"id":"jvasp-31872","created_at":"2022-09-04T14:38:02.984719Z","updated_at":"2022-09-04T14:38:02.984746Z","structure_string":"Ir4 F24\n1.0\n4.940801 -0.000000 0.000000\n-0.000000 8.527015 0.000000\n0.000000 0.000000 9.315857\nIr F\n4 24\ndirect\n0.589064 0.250000 0.126754 Ir\n0.910936 0.250000 0.626754 Ir\n0.410936 0.750000 0.873246 Ir\n0.089064 0.750000 0.373246 Ir\n0.931110 0.594504 0.257971 F\n0.068889 0.094504 0.742030 F\n0.103121 0.750000 0.754802 F\n0.896879 0.250000 0.245199 F\n0.568889 0.594504 0.757971 F\n0.603121 0.250000 0.745199 F\n0.068889 0.405497 0.742030 F\n0.431110 0.094504 0.242030 F\n0.251956 0.594416 0.988306 F\n0.717490 0.750000 0.992273 F\n0.782509 0.750000 0.492273 F\n0.431110 0.405497 0.242030 F\n0.396879 0.750000 0.254801 F\n0.751955 0.405585 0.511694 F\n0.248044 0.905585 0.488306 F\n0.282510 0.250000 0.007727 F\n0.568889 0.905497 0.757971 F\n0.748044 0.094416 0.011694 F\n0.217490 0.250000 0.507727 F\n0.931110 0.905497 0.257971 F\n0.251956 0.905585 0.988306 F\n0.248044 0.594416 0.488306 F\n0.748044 0.405585 0.011694 F\n0.751955 0.094416 0.511694 F\n","nsites":28,"nelements":2,"elements":["Ir","F"],"chemical_system":"F-Ir","density":5.182121549086677,"density_atomic":0.07134126876299311,"volume":392.4797033400176,"volume_molar":8.441314353416528,"formula_full":"Ir4 F24","formula_reduced":"IrF6","formula_anonymous":"AB6","energy_above_hull":0.3987703992857141,"spacegroup":62},{"id":"jvasp-55936","created_at":"2022-09-04T14:38:03.129343Z","updated_at":"2022-09-04T14:38:03.129366Z","structure_string":"As8 O16\n1.0\n5.343042 -0.000000 0.000000\n-0.000000 7.304757 0.000000\n0.000000 0.000000 8.544340\nAs O\n8 16\ndirect\n0.250000 0.700410 0.768608 As\n0.750000 0.299590 0.231392 As\n0.750000 0.200410 0.731392 As\n0.250000 0.799590 0.268608 As\n0.250000 0.328393 0.569629 As\n0.750000 0.671608 0.430371 As\n0.750000 0.828393 0.930371 As\n0.250000 0.171608 0.069629 As\n0.505230 0.320822 0.080593 O\n0.005231 0.679178 0.919407 O\n0.505230 0.179178 0.580593 O\n0.005231 0.820823 0.419407 O\n0.494769 0.679178 0.919407 O\n0.994769 0.320822 0.080593 O\n0.250000 0.054449 0.249305 O\n0.250000 0.054151 0.902684 O\n0.750000 0.554449 0.250695 O\n0.250000 0.445551 0.749305 O\n0.994769 0.179178 0.580593 O\n0.750000 0.945849 0.097317 O\n0.750000 0.554151 0.597317 O\n0.250000 0.445849 0.402683 O\n0.750000 0.945551 0.750695 O\n0.494769 0.820823 0.419407 O\n","nsites":24,"nelements":2,"elements":["As","O"],"chemical_system":"As-O","density":4.259187667566411,"density_atomic":0.0719678218549638,"volume":333.4823728355572,"volume_molar":8.367824125810525,"formula_full":"As8 O16","formula_reduced":"AsO2","formula_anonymous":"AB2","energy_above_hull":1.7175862500000003,"spacegroup":62},{"id":"jvasp-55829","created_at":"2022-09-04T14:38:03.202471Z","updated_at":"2022-09-04T14:38:03.202494Z","structure_string":"Co8 Si4 O16\n1.0\n4.868089 0.000000 0.000000\n0.000000 5.915128 0.000000\n0.000000 0.000000 10.155555\nCo Si O\n8 4 16\ndirect\n0.507258 0.250000 0.230573 Co\n0.992742 0.250000 0.730573 Co\n0.492742 0.750000 0.769427 Co\n0.007258 0.750000 0.269427 Co\n0.500000 0.500000 0.500000 Co\n0.000000 0.500000 0.000000 Co\n0.500000 0.000000 0.500000 Co\n0.000000 0.000000 0.000000 Co\n0.569367 0.750000 0.093910 Si\n0.069367 0.250000 0.406090 Si\n0.430633 0.250000 0.906090 Si\n0.930633 0.750000 0.593910 Si\n0.732612 0.250000 0.408180 O\n0.232612 0.750000 0.091820 O\n0.791064 0.750000 0.443839 O\n0.291064 0.250000 0.056161 O\n0.208936 0.250000 0.556161 O\n0.708936 0.750000 0.943839 O\n0.716319 0.971368 0.164962 O\n0.716319 0.528633 0.164962 O\n0.283681 0.471367 0.835038 O\n0.783681 0.528633 0.664963 O\n0.283681 0.028633 0.835038 O\n0.783681 0.971368 0.664963 O\n0.267388 0.750000 0.591820 O\n0.216319 0.471367 0.335038 O\n0.216319 0.028633 0.335038 O\n0.767388 0.250000 0.908181 O\n","nsites":28,"nelements":3,"elements":["Co","Si","O"],"chemical_system":"Co-O-Si","density":4.7686735598394305,"density_atomic":0.09574844119905826,"volume":292.4329592143313,"volume_molar":6.289544440185865,"formula_full":"Co8 Si4 O16","formula_reduced":"Co2SiO4","formula_anonymous":"AB2C4","energy_above_hull":2.9192320571428567,"spacegroup":62}]}