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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems  _ _'M  l 6df72d970065d1c843eae4273b3f5221@4sUj@9>Z%mse-guccm @-l@dw @h\8?0Bx?Cn?}R?0Bx?@ @ r?<.9??ܵ?(' @?/r?,ypw??_LJ? r?( @?ܵ?]`7l@u<@Y?kC8@#Jv@g@?u<@x@V@}t@|y@䠄@#Jv@"@Q@}t@v3@m @u< @dw @#0?/?!rh?&S@/?@סܮ~i.˚ @8e_ @== @Y2 @[s @.˚ @x֓ivasp{}`tA`tAXCq?Jcqne/ިEJc?qne/ިE?*5{XD6.6d*4P?u8JwwD6.6d?*4P?u8Jww?9̗'O;5Y^$Dr?ض(A&Y?CO}:n>4aX(&oiO;5Y^?$Dr?ض(A&Y.X?.d``CO}:n?>4aX(&oi?.X.d``?+XX?}!SK?2I>Vf?}!S?K?2I>Vf`AW?ub{" ⛎ '?`׆1>{"gap": 1.995958, "C_rate": 0.625, "mean_energy": 0.4573942950000003}{}?yݬ?' @WXjTX@hQE #M 6df72d970065d1c843eae4273b3f5221   systems      # mean_energy  C_rate gap  # mean_energy?E򸙺 C_rate? gap?qx  version9 #M 6df72d970065d1c843eae4273b3f5221   @4sUj   mse-gucc  vasp   #mean_energy C_rate gap  #mean_energy C_rate gap