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 8ef50d2e604befa33d2866b9cd6e9fe1@7~ zM@9hhecc//////////////////////////////////////////////////////w?w?ZBs'@w?⪲@rCQ'@w?܀#D@rCQ'@⪲@w?rCQ'@M(D@M(D@(''@M(D@C9N@(''@܀#D@w?rCQ'@C9N@M(D@(''@C9N@C9N@(''@%?Clg@)Wx#@׆q&d?HȰw@\[%X#@%?%?)Wx#@Clg@Clg@)Wx#@',r@HȰw@\[%X#@Clg@%?)Wx#@HȰw@',r@\[%X#@HȰw@HȰw@!<8#@HȰw@׆q&d?\[%X#@w?w?Psײ@w?Y@@w?ǺP@@Y@w?@KqUٗ@KqUٗ@g@KqUٗ@ m9W@g@ǺP@w?@ m9W@KqUٗ@g@ m9W@ m9W@g@)'$!@}y@wN#m@ [!@HȰw@Ywg@)'$!@)'$!@wN#m@}y@}y@wN#m@M@HȰw@Ywg@}y@)'$!@wN#m@HȰw@M@Ywg@HȰw@HȰw@n/i@HȰw@ [!@Ywg@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?w?:ǀe,@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{}aV%Pa9^Q@ޫV&r/K;5Kdǚa?/K;5K?dǚa?/K;5Kdǚa?O!WY`O!WY`Q3Uv?O!WY`O!WY`?Q3Uv?/K;5K?dǚa?O!WY`?O!WY`Q3Uv?O!WY`?O!WY`?Q3Uv?W$&[xW$&[x?"\?=Ny?иp $ x?W$&[xW$&[x"\?W$&[x?W$&[x?"\?=Nyиp $ x?W$&[x?W$&[x"\?=Nyиp $ x?bFx{P=Ny?иp $ x?Q,r?_V? s 34~?_V s 34~?_V? s 34~?;P"Dikik?>"D<j?j{ ik?ik>"Dik?ik?>"DQi>qQi>q?ۋh;?NE*-8~߿?Qi>qQi>qۋh;?Qi>q?Qi>q?ۋh;?NE*-?8~߿?Qi>q?Qi>qۋh;?NE*-?8~߿?01"Qh?NE*-8~߿?>M|?k[Xt?k[Xt?G"0C?0{"str_E": -141.96977, "slab_E": -138.95552, "atom_E": -0.24284194, "ads_E": -2.771408060000004, "distance": 2.38729, "Dipole_val": 3.01414, "plane_index": 100, "ads_site": "0t"}{}7?#?tX[k@-+Jl@U2a| #M 8ef50d2e604befa33d2866b9cd6e9fe1   systems   /6   ads_site# plane_index ! Dipole_val  distance ads_E  atom_E  slab_E str_E  ads_site0t rr# plane_indexd! Dipole_val@n distance@+ ads_E+,  atom_Eq2C slab_Ea^Ց str_Ea[T  version9 #M 8ef50d2e604befa33d2866b9cd6e9fe1   @7~ zM  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