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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)‡etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems   ‡^&Ml„L„Ll= 76b4b9c2013f27742418d1529fefc2d4@5STk¸p@9~› yangxbOOOOOOOO vöE9@g¸Ÿ@$@ýM(DÀá@:;%o@$@6<½R–!ï?pUjÖ@$@„õóÅ@Ì—`ù?$@xî=\rœ@6°U‚Å@$@’tÍä›mà?KqUÙw @$@æ?¤ß¾Ž @!<Ú8b- @$@}iÆb@wgí¶‹ó?$@q à-ö?7ýÙ‘ê?$@.VÔ`@ 2þ}Æõ @$@bodù@š%jj™@$@RÑèb@÷Xúð@$@±1Ž%ª@€€2݆yØž"@4@vasp{}ÀF,.dß¿ÀF2蟑*¤‹¦³c?ž}åAzŠ|?¤‹¦³c¿ž}åAzŠ|¿¤‹¦³c?ž}åAzŠ|¿€¤‹¦³c¿ž}åAzŠ|?/ó:âp?dËòuþs¿€/ó:âp¿dËòuþs?/ó:âp?dËòuþs?€/ó:âp¿dËòuþs¿–—üOþîm¿yž"‡ˆk¿–—üOþîm?yž"‡ˆk?–—üOþîm¿yž"‡ˆk?€–—üOþîm?yž"‡ˆk¿€<ï8â?ïáŘö¿OŸGðz€D?€€{"E": 0.24469818416666644, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333}{} ?~1p7§³o?D€zðGŸO@–Mç}3©B@š`JKM ÜÜ#M 76b4b9c2013f27742418d1529fefc2d4 ôô  systems ðøð O  âúîâ  Si_rate  Au_rate E  ÇñÜÇ Si_rate?ÕUUUUUU Au_rate?åUUUUUU  E?ÏRE%1v óó version9 ÜÜ#M 76b4b9c2013f27742418d1529fefc2d4 ôô  @5STk¸p öö  yangxb øø vasp õûõO  ãïûã Si_rate Au_rate E  ãïûã Si_rate Au_rate E