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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)‡etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems   ‡^&Ml„L„Ll= dcb272b2c40fe5de901e3b38279410d6@5STehÉ@9$¾' =yangxbOOOOOOOOëâ6€ @“RÐí%í@$@!ÈA 3íþ?½ÞýÑ@$@Ôe1±ùx@õ¡ ê[f(@$@„dè? {Úá¯Éó?$@¢—Q,·t@Ǻ¸¦@$@Ñ?ÁÅŠð?j¼t“@$@¸éÏ~¤ˆ @œ¿ …8î?$@\Âõ(Üú?ë­­ü(@$@î v¦Ðã?z]¢zÛ#@$@áz®G@8-xÑW @$@,g~5‡@;Sè¼Æ® @$@:#J{ƒo @ùƒçÞs$@$@º©•ÊZ{@€8ÖŸ¦‘ß*@4@vasp{}ÀEä]yÃ:}ÀEêô ¾ÊÖàL£ÉÅh¿æÎL0œkh¿Ã L£ÉÅh?æÎL0œkh?€Ã L£ÉÅh?æÎL0œkh¿Ã L£ÉÅh¿æÎL0œkh?Ž¬ü2#b?@¤ß¾œƒ¿€Ž¬ü2#b¿@¤ß¾œƒ?€Ž¬ü2#b¿@¤ß¾œƒ¿Ž¬ü2#b?@¤ß¾œƒ?€XÇñC¥a?‘BYøúZg?XÇñC¥a¿‘BYøúZg¿€XÇñC¥a¿‘BYøúZg?€XÇñC¥a?‘BYøúZg¿Ãaï\€ÆѾ¾ïîœeÅ ¿ Nº†>±A?€€€{"E": 0.29145344583333327, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333}{} ?„ ‚ë$K³?A±>†ºN @–Œâ÷"ô+@š`JKM ÜÜ#M dcb272b2c40fe5de901e3b38279410d6 ôô  systems ðøð O  âúîâ  Si_rate  Au_rate E  ÇñÜÇ Si_rate?ÕUUUUUU Au_rate?åUUUUUU  E?Ò§,ZŠH{ óó version9 ÜÜ#M dcb272b2c40fe5de901e3b38279410d6 ôô  @5STehÉ öö  yangxb øø vasp õûõO  ãïûã Si_rate Au_rate E  ãïûã Si_rate Au_rate E