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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)‡etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems  · ·ˆF&M|…,…,l= 7ffd58ef847b600c984e54e091299d1b@5STYî?µ@9$Æ›²Ó?yangxbOOOOOOOOOOvT5AÔý@±3…ÎkL@$@p|í™% @ñh㈵xù?$@åa¡Ö4? @ñh㈵xù?$@UDÝ@"@±3…ÎkL@$@¸Ì鲘X@6ñº~@$@]3ùf››ö?Çô„%PÊ?$@•š=Ð ,$@Çô„%PÊ?$@JµOÇc¦@6ñº~@$@?Œm,$@ËǺ¸Í@$@öÑ©+Ÿ¥@Úá¯ÉÕ@$@ °N]Y@Úá¯ÉÕ@$@ ¦aøˆ˜ö?ËǺ¸Í@$@sh‘í|ÿ@4¿šsù?$@B 3mÿJ@$@lê}ÿ&@ºR€<|Ü@4@vasp{}ÀI°î[¾ÀI Tz¿d$Dù‚B¿ÅÚÇ ~K¿$Dù‚B?ÅÚÇ ~K¿€$Dù‚B¿ÅÚÇ ~K¿€$Dù‚B?ÅÚÇ ~K¿íõî÷ªe?fLÁgÓ?íõî÷ªe¿fLÁgÓ?€íõî÷ªe?fLÁgÓ?€íõî÷ªe¿fLÁgÓ? «x#óÈo?gd»Sd? «x#óÈo¿gd»Sd? «x#óÈo?gd»Sd? «x#óÈo¿gd»Sd?€€t·ë¥)l¿€t·ë¥)l¿€SÁŽjŸ¾Ÿ2¼ü]]ü>WÖÒKò@?€€€{"E": 0.26009343428571413, "Au_rate": 0.7142857142857143, "Si_rate": 0.2857142857142857}{}?rÝ(ìÎ8?@òKÒÖW@šÓáWá@ DéÌ·Ô ÜÜ#M 7ffd58ef847b600c984e54e091299d1b ôô  systems ðøð O   âúîâ  Si_rate  Au_rate E  ÇñÜÇ Si_rate?ÒI$’I$’ Au_rate?æÛm¶Ûm·  E?Ð¥^îŠU{ óó version9 ÜÜ#M 7ffd58ef847b600c984e54e091299d1b ôô  @5STYî?µ öö  yangxb øø vasp õûõO  ãïûã Si_rate Au_rate E  ãïûã Si_rate Au_rate E