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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems  N'ML  l; 52c131a0559e17263d249adfff384cdb@5ST^;BA@9$p /yangxbOOOOOOOOOOOOOOOOaq8y @n)R(@$@)3h@%@$@Ĭ!@qm7 @$@IZV?מY?$@)3h@מY?$@aq8y @qm7 @$@IZV?%@$@Ĭ!@n)R(@$@n@1D$@$@S㥛@|\* @$@x$@1D$@$@hW!?|\* @$@&1|@c&8)@$@T[(@9#j@$@8ߡ?3@$@= ףp=#@8L?$@T[(@8L?$@&1|@3@$@= ףp=#@9#j@$@8ߡ?c&8)@$@|y@|\* @$@@߾<@1D$@$@H @|\* @$@4 @1D$@$@rR%@_++@4@vasp{}U> 6:V5aJ>Lƽ SJ>L?ƽ SJ>Lƽ S?J>L?ƽ S?J>L?ƽ S?J>Lƽ S?J>L?ƽ SJ>Lƽ Sp$`S?p$`S灿p$`S?p$`S灿 Lnygd? Lny?gd? Lnygd Lny?gd Lny?gd Lnygd Lny?gd? Lnygd?MVMV?MVMV?Bh> (K'B?{"E": 0.2752571308333331, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333}{}?S`$p?B'K@+(/`@`JKM #M 52c131a0559e17263d249adfff384cdb   systems  O    Si_rate  Au_rate E   Si_rate?UUUUUU Au_rate?UUUUUU  E?ѝ  version9 #M 52c131a0559e17263d249adfff384cdb   @5ST^;BA   yangxb  vasp O   Si_rate Au_rate E   Si_rate Au_rate E