SQLite format 3@ .  ? ^ B 8Ed\%/sindexnumber_indexnumber_key_valuesCREATE INDEX number_index ON number_key_values(key)T!+kindextext_indextext_key_valuesCREATE INDEX text_index ON text_key_values(key)<Sindexkey_indexkeysCREATE INDEX key_index ON keys(key)H ']indexspecies_indexspeciesCREATE INDEX species_index ON species(Z)W -uindexcalculator_indexsystems CREATE INDEX calculator_index ON systems(calculator)Q )mindexusername_indexsystems CREATE INDEX username_index ON systems(username)H #aindexctime_indexsystems CREATE INDEX ctime_index ON systems(ctime)T +qindexunique_id_indexsystems CREATE INDEX unique_id_index ON systems(unique_id)[##tableinformationinformation CREATE TABLE information ( name TEXT, value TEXT)*//tablenumber_key_valuesnumber_key_valuesCREATE TABLE number_key_values ( key TEXT, value REAL, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems u(MD\{\lu 2c31fbeda128c7d29933599a74f2b0bc@7~ @950hecc //////////////////////////////////////////////////////w?p_+@w?u&?_FҚ'@w?D!T@<,'@w? T@_FҚ'@qrCQ@Mo?:X0'@ԕ@D!T@:3P'@qrCQ@,eXW@:X0'@n@Mo?:X0'@x@Y@D!T@:3P'@n@,eXW@:X0'@4)!@w@3d#@4)!@Dp@3d#@D s?D4؉#@Dio@w@3d#@Dio@Dp@3d#@Y8m@D4؉#@HȰw@ؙBg@b #@HȰw@@@b #@HȰw@+ٞ#@w?֨ht?CB@w?D!T@[Ӽ@w?6 rQ@CB@W!'՞@aod?bE @M(D@D!T@n)@W!'՞@'kC4Z@bE @89@P@aod?bE @wR~RM@D!T@n)@89@P@'kC4Z@bE @8ߡ!@y]z@&R?oj@8ߡ!@fu@&R?oj@HGŗ!@ %l@F=D{@y]z@&R?oj@F=D{@fu@&R?oj@Y@ %l@HȰw@&ǝz@ΪVl@HȰw@u@ΪVl@HȰw@umn@w?w?R!5 @w?D!T@R!5 @w?LTo lU@R!5 @D!T@w?R!5 @D!T@D!T@R!5 @D!T@LTo lU@R!5 @LTo lU@w?R!5 @LTo lU@D!T@R!5 @LTo lU@LTo lU@R!5 @HȰw@^o%;?HȰw@^o%;?^o%;?HȰw@HȰw@^o%;?HȰw@HȰw@^o%;?HȰw@^o%;?HȰw@HȰw@^o%;?HȰw@HȰw@^o%;?HȰw@^o%;?g!@g!@7@@[{"name": "FixAtoms", "kwargs": {"indices": [37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54]}}]vasp{}a?,a'b)r?^sawДm?*4P?^saw?Дm? [_<ܴYru?*5{X?tip? [_<ܴY?ru? [_?<ܴYru?*5{Xtip? [_?<ܴY?ru?rhb6:B? @m?rhb6:B @m?]@"IJ y[rhb?6:B? @m?rhb?6:B @m?]@"I?J y[&|G:vPh?&|G?:vPh?|u?  RDkHcCg?yz?  RD?kHcCg?Q,Z W?V6od?Qnd${!u?Q,Z WV6od?Q,Z? W?V6od?Qn?d${!u?Q,Z? WV6od?'d?מYbh^^?'d?מYb?h^^? 'ih? q{?'dמYbh^^?'dמYb?h^^? 'ih q{?qnce7idqnc?e7idʩajK]?wkF=? ҸddY0wkF= Ҹ>Vf?AҧU2p@x`?>Vf?AҧU?2p@>VfAҧU2p@x`>VfAҧU?2p@MۿҤdaX5s?e۹?MۿҤdaX5se۹?59Z̸?MۿҤd?aX5s?e۹?MۿҤd?aX5se۹?5?9Z̸?GW?DXP?GWDXP?vuŌ?1dgpx?̈u?/lSC?>I6{"str_E": -141.65347, "slab_E": -138.95552, "atom_E": -0.29474202, "ads_E": -2.4032079799999915, "distance": 1.97248, "Dipole_val": -0.392312, "plane_index": 100, "ads_site": "1b"}{}7?~?s)sX?xpgd1@-+Jl@EI, #M 2c31fbeda128c7d29933599a74f2b0bc   systems  /6   ads_site# plane_index ! Dipole_val  distance ads_E  atom_E  slab_E str_E  ads_site1b rr# plane_indexd! Dipole_valu distance?G0@9 ads_E9 atom_E *  slab_Ea^Ց str_Ea9Y  version9 #M 2c31fbeda128c7d29933599a74f2b0bc   @7~   hecc  vasp /  ads_site#plane_index!Dipole_val distance ads_E atom_E slab_E str_E   ads_site #plane_index!Dipole_val distance ads_E atom_E slab_E str_E