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 r(MD\{\lo c79c9448af02b5403dfc32291160d929@7~ -@91ghecc//////////////////////////////////////////////////////w?umn?CR'@w?D!T@@߾'@w?3@CR'@\Z {@h"lxz?'@IZ@D!T@ S"'@\Z {@kI@'@ m9B@h"lxz?'@*g\X@D!T@ S"'@ m9B@kI@'@ZM?O@ı.n#@ZM?%@M-[@ı.n#@ڐ?Ws`#@p1=a@O@ı.n#@p1=a@%@M-[@ı.n#@ͪU@Ws`#@HȰw@2s@8 #@HȰw@MbXy@8 #@HȰw@^K=#@w?ʄ_g?F%u@w?D!T@JFž@w?KqUY@F%u@Fžv@ۢd?ݵ|@g'@D!T@ٙB5@Fžv@y)Z@ݵ|@JFžV@ۢd?ݵ|@) 0Y@D!T@ٙB5@JFžV@y)Z@ݵ|@ !@Z| q@8*u@ !@ z@8*u@|͍!@ݰmq@ȵb@Z| q@8*u@ȵb@ z@8*u@6Tw@ݰmq@HȰw@k}Жs@aMy@HȰw@䠄y@aMy@HȰw@4 r@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%;?w?!rhm*@g!@g!@7@@[{"name": "FixAtoms", "kwargs": {"indices": [36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53]}}]vasp{}a=a=or„ѬlO?pW?S[ c?r„ѬlOpW?iI g_vOV"jGY?h#M)edǚa?iI g_vOV?"jGY?iI g?_vOV"jGY?h#M)e?dǚa?iI g?_vOV?"jGY?TsPEy7FF~,lTsPEy7F?F~,l_ `?\ mTsPE?y7FF~,lTsPE?y7F?F~,l_ `\ m*Ŏơ~W?:`4*Ŏơ~W:`44Lm^?>Vf?iWsIvS?>VfiW;Fzq?E&HR??̔"+Sp?tiP;Fzq?E&HR?̔";FzqE&HR??̔"+SptiP;FzqE&HR?̔"]2^m?_Qk?@0`U?1>^m?_Qk@0`U?^k?I5o?1>^m_Qk?@0`U?1>^m_Qk@0`U?^kI5o? +jc?>I? +jc>I?4}v?Ɍ^kT2x?GiKu?ؗM?5{"str_E": -143.90867, "slab_E": -138.95552, "atom_E": -1.5326215, "ads_E": -3.4205284999999934, "distance": 1.30127, "Dipole_val": 1.94806, "plane_index": 100, "ads_site": "1b"}{}7?v]9~?x2T@-+Jl@ὥ #M c79c9448af02b5403dfc32291160d929   systems   /6   ads_site# plane_index ! Dipole_val  distance ads_E  atom_E  slab_E str_E  ads_site1b rr# plane_indexd! Dipole_val?+@jU distance?}A5 ads_E ]> I atom_E:W slab_Ea^Ց str_Eag  version9 #M c79c9448af02b5403dfc32291160d929   @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