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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)‡etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems   ‡^&Ml„L„Ll= 610ff1046bf62a5a78e1926579d8ccf9@5STih±k@9$Ä ã™.yangxbOOOOOOOO YÝê9@–¨©e @$@cÙ=yØ@ê!ÝAl@$@f1±ù¸6ï?Iô2ŠåÖ@$@sôø½M¿@ …8„ªù?$@«²ïŠàö?÷Ç{ÕÊ„ê?$@߉Y/@FΞvø @$@‰ÒÞà ó@qr¿CQ @$@gòÍ67f@S\Uö]ñ@$@¤#ÖâSà?^üo%{ @$@Z!«›@Ý 7àóƒ@$@“Wç]@"¦D½Œó?$@Sè¼Æ.‘ @öÑ©+/ @$@iA¸š&¦@€ïÍ<§Ã "@4@vasp{}ÀF,HÀc1þÀF2;º*Þ¦&z‹‡÷l?Á=~oƒ¿€&z‹‡÷l¿Á=~oƒ?€&z‹‡÷l?Á=~oƒ?€&z‹‡÷l¿Á=~oƒ¿.‘ ÎàŸ<,Ôšæ}¿€.‘ Îàï‡?Ÿ<,Ôšæ}?.‘ ÎàŸ<,Ôšæ}?€.‘ Îàï‡?Ÿ<,Ôšæ}¿‚;P§<ºq?<†Ç~Ka¿€‚;P§<ºq¿<†Ç~Ka?‚;P§<ºq?<†Ç~Ka?€‚;P§<ºq¿<†Ç~Ka¿Ü*÷x€…?’¨æ¾Ä¯ø>±Ê¦Zl•D?€€{"E": 0.24463115000000032, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333}{} ?Œ8å–«û°?D•lZ¦Ê±@–MKÓãGé@š`JKM ÜÜ#M 610ff1046bf62a5a78e1926579d8ccf9 ôô  systems ðøð O  âúîâ  Si_rate  Au_rate E  ÇñÜÇ Si_rate?ÕUUUUUU Au_rate?åUUUUUU  E?ÏPÒj›‹ óó version9 ÜÜ#M 610ff1046bf62a5a78e1926579d8ccf9 ôô  @5STih±k öö  yangxb øø vasp õûõO  ãïûã Si_rate Au_rate E  ãïûã Si_rate Au_rate E