SQLite format 3@ .° ø° ?É í ^ é B • 8â˜Eì¢d°\%/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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)‡etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems   ‹h'M<ˆ,ˆ,l? 5d101d8ed96d1a4a56f79c694272791a@5ST~Ë‚¥@8ßYFŸïyangxbOOOOOOOOOOOOOOü¤6qò@!YÀn}&@$@%éšÉ7@$@ƒ4cÑtf&@$@ü¤6qò@sôø½M¿ @$@Ñy]¢@€$@ØG§®¼@ÌîÉÃBí@$@Mu€”@€$@ªñÒMbP@ÌîÉÃBí@$@ü¤6qò@ÌîÉÃBí@$@$@ü¤6qò@è¤÷¯-+@$@ <÷n@$@¼è+H3¶!@$@ü¤6qò@±Š72üõ?$@Ih˹—@aÃÓ+eY@$@]3ùf››þ?ÙÎ÷S#)@$@]3ùf››þ?ÖVì/»'@$@Ih˹—@ à-À#@$@ÓMbX™@ à-À#@$@ µ‰“û=@ÖVì/»'@$@ µ‰“û=@ÙÎ÷S#)@$@ÓMbX™@aÃÓ+eY@$@êñ”pò!@€ö-ô:Bí-@4@vasp{}ÀTrn!p¾ÀTwW2×BǀàL£ÉÅH¿€€Ã L£ÉÅH¿€Ã L£ÉÅH?€€Ã L£ÉÅH?ÿ$>w‚ýw?€€ÿ$>w‚ýw¿€ÿ$>w‚ýw¿€ÿ$>w‚ýw?€€€€€€€*ª~¥óáy¿€€*ª~¥óáy¿€*ª~¥óáy?€*ª~¥óáy?€© ¢êW:_?)_ÐBFw?© ¢êW:_¿)_ÐBFw?€© ¢êW:_¿)_ÐBFw¿© ¢êW:_?)_ÐBFw¿© ¢êW:_¿)_ÐBFw¿€© ¢êW:_?)_ÐBFw¿© ¢êW:_?)_ÐBFw?© ¢êW:_¿)_ÐBFw?€Œ–­GÜa¿àùo‰¤?ï²@?€€€{"E": 0.28994228000000016, "Au_rate": 0.6363636363636364, "Si_rate": 0.36363636363636365}{}?yáó¥~ª*?@²ï@¤úømZ·Ê@§Ll†Î»¼ ÜÜ#M 5d101d8ed96d1a4a56f79c694272791a ôô  systems ðøð O  âúîâ  Si_rate  Au_rate E  ÇñÜÇ Si_rate?×EÑt]F Au_rate?ä]EÑt]  E?ÒŽj”ø£ óó version9 ÜÜ#M 5d101d8ed96d1a4a56f79c694272791a ôô  @5ST~Ë‚¥ öö  yangxb øø vasp õûõO  ãïûã Si_rate Au_rate E  ãïûã Si_rate Au_rate E