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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)‡etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems   ‡^&Ml„L„Ll= f4b6d08fa9aa4ab66339faa4acfe1fff@5STr™œ@9$¾ág#yyangxbOOOOOOOO.VÔ`&@ÅUeß@¡JÍþ#@´«ò“j@èŸàbE ð?¡JÍþ#@PSËÖúâ@Ë-­†Ä}@þñ^µ2$@ábE ¦áù?½5°U‚E@þñ^µ2$@õÖÀV Ö@ÒŒEÓÙ @æË $@Ž@¼®_ð@µÃ_“5êõ?æË $@½ʉvê?å›mnL@ã4ôÿ#@x´qÄZ !@°þÏa¾¼@ã4ôÿ#@À!T©Ùƒ @z]¢z« @pënžê$@DL‰$z™@æØG§.@pënžê$@Év¾Ÿ¯ó?…=íð—@‘aÿ#@+‡ÙÎ7 @ep”¼:ÇÞ?‘aÿ#@{„tZ²­"@Ænðœe„@4@vasp{}ÀF,ë7Æë·ÀF3) +!T1³Ïcd?Ð ¡ƒ.áp¿hÊN?¨‹D¿T1³Ïcd¿Ð ¡ƒ.áp?hÊN?¨‹D¿T1³Ïcd¿Ð ¡ƒ.áp¿hÊN?¨‹D?T1³Ïcd?Ð ¡ƒ.áp?hÊN?¨‹D?—Mõdþ¿5Ð|ÎÝ®g?XÇñC¥Q?—Mõdþ?5Ð|ÎÝ®g¿XÇñC¥Q?—Mõdþ?5Ð|ÎÝ®g?XÇñC¥Q¿—Mõdþ¿5Ð|ÎÝ®g¿XÇñC¥Q¿Î’Z(™l?ÿÎöè ÷q?Ï ¡‚‹U?Î’Z(™l¿ÿÎöè ÷q¿Ï ¡‚‹U?Î’Z(™l¿ÿÎöè ÷q?Ï ¡‚‹U¿Î’Z(™l?ÿÎöè ÷q¿Ï ¡‚‹U¿×hZÝþÝæ¾âò/˜‹ê>h2ï¾bF?€€€{"E": 0.24421797666666686, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333}{} ?ƒõ3[~?Fb¾ï2h@–D&Ån€þ@š`JKM ÜÜ#M f4b6d08fa9aa4ab66339faa4acfe1fff ôô  systems ðøð O  âúîâ  Si_rate  Au_rate E  ÇñÜÇ Si_rate?ÕUUUUUU Au_rate?åUUUUUU  E?ÏBˆßpvË óó version9 ÜÜ#M f4b6d08fa9aa4ab66339faa4acfe1fff ôô  @5STr™œ öö  yangxb øø vasp õûõO  ãïûã Si_rate Au_rate E  ãïûã Si_rate Au_rate E