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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)‡etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems   ‡^&Ml„L„Ll= 89980108458ad360c7f349be1ccef193@5STP°jU@8ûuï^âyangxbOOOOOOOOiŒÖQÕ4!@“Wç=@$@ B²€ ç?³µ¾Hhk@$@µ‰“ûŠ@Ásïá’ãò?$@½ãÉ…@ÚæÆô„@$@Zžwg­@-²ï§@$@´vÛ…æ: @ã4ôÏ@$@åòÒoo @!«[='æ?$@«ÏÕVì¯ñ?ý¼©H…@$@IKåí'ø? K< lJù?$@â|~A@¬Zd;Ÿ@$@V‚ÅáÌo @ض(³A& @$@‰˜Iô@VeßÁ_@$@Î:Ì_m¥"@ß™â?™@4@vasp{}ÀF,)UcߣÀF2<×vÉá&:Ë,B±E?;ÿvÙ¯;}¿&:Ë,B±E¿;ÿvÙ¯;}¿]‰@õ"I?°Y.óƒ?€]‰@õ"I¿°Y.óƒ?€3¨68ýz?×÷á !ÊG?3¨68ýz¿×÷á !ÊG?”g^»ïH¿€ GJ¿€”g^»ïH?€ GJ¿€ —8ò@dq?É¡fHe?€ —8ò@dq¿É¡fHe?€ÿæʼn¯vd?˜iûWVšd?€ÿæʼn¯vd¿˜iûWVšd?€Ôé}]eæ>[Ü¿ö >k FOìC?€€€{"E": 0.24471105000000026, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333}{} ?„kW3!=?CìOF k@–I{dðƒ@š`JKM ÜÜ#M 89980108458ad360c7f349be1ccef193 ôô  systems ðøð O  âúîâ  Si_rate  Au_rate E  ÇñÜÇ Si_rate?ÕUUUUUU Au_rate?åUUUUUU  E?ÏR±\# óó version9 ÜÜ#M 89980108458ad360c7f349be1ccef193 ôô  @5STP°jU öö  yangxb øø vasp õûõO  ãïûã Si_rate Au_rate E  ãïûã Si_rate Au_rate E