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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)‡etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems  ‡]&Ml„L„Ll; c2f03166974b694f533973ec568ff714@5SThÙd¶@9 6ÕWw¼yangxbOOOOOOOO ý\,@Kº ¾e@$@«ÏÕVìo@¢zk`«D@$@Ò:ªš ê@æØG§n@$@)èö’Æèù?úÕ ˜#ð?$@á—úyS!@¹ðÈõ?$@Ì(–[Z ê?ÚæÆô„@$@²ºÕó@’èeË­@$@Å™Gþà@lCÅ8“@$@«ì»"øŸ@Kê46Þ?$@›r…w¹ˆ @£;ˆ)”@$@—­õEB; @É“¤k&@$@ºfòÍ6·ó?ÿìGŠÈ° @$@Pc­g)²"@›h胋w@4@vasp{}ÀF-.¢Ç6ÀF3«fJ¸ü©ñÒMb ¿á iTàd[?ü©ñÒMb ?á iTàd[¿€ü©ñÒMb ?á iTàd[?ü©ñÒMb ¿á iTàd[¿€MÙéua¿º„Coñð~¿€MÙéua?º„Coñð~?€MÙéua?º„Coñð~¿€MÙéua¿º„Coñð~?QfƒL2rF?ÙÎ÷Sã¥k?€QfƒL2rF¿ÙÎ÷Sã¥k¿QfƒL2rF¿ÙÎ÷Sã¥k?€QfƒL2rF?ÙÎ÷Sã¥k¿eêáúUÚ¾~W{iuP ¿lX?ßD?€€€{"E": 0.2440465266666664, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333}{} ?€ ¨ØÌ?Dß?Xl@–@•©\)@š`JKM ÜÜ#M c2f03166974b694f533973ec568ff714 ôô  systems ðøð O  âúîâ  Si_rate  Au_rate E  ÇñÜÇ Si_rate?ÕUUUUUU Au_rate?åUUUUUU  E?Ï<ê¥^,5 óó version9 ÜÜ#M c2f03166974b694f533973ec568ff714 ôô  @5SThÙd¶ öö  yangxb øø vasp õûõO  ãïûã Si_rate Au_rate E  ãïûã Si_rate Au_rate E