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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)‡etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems   ‡^&Ml„L„Ll= 6d56c11deab53176a29f91f976cf013e@5ST`®eD@9$¿v÷»ÓyangxbOOOOOOOOÝAìL!ú?„d@$@LTo lõ@®GázT@$@]Pß2G@N ^ô•ð?$@Ý^Òm@0ðÜ{8@$@¢‚‹õ@ ý\ @$@á—úyS@f 2þ}Fõ?$@ÄÎ:¯±é?Ñ:ªš€@$@ݘž°Ä#!@ídp”¼º@$@÷’ÆhE @×/Ø Û–@$@’–ÊÛÎó?‹T[rÜ?$@I€šZ¶– @¼®_°ö@$@n‹2d²@ª&ˆºÏ @$@Lö~ß¾"@€ñŒ³rú]@4@vasp{}ÀF*ƒ"IV ÀF1ÇJVæu”ƒÙ†?‡¨ÂŸáÍ¢?€u”ƒÙ†¿‡¨ÂŸáÍ¢¿€u”ƒÙ†?‡¨ÂŸáÍ¢¿€u”ƒÙ†¿‡¨ÂŸáÍ¢?6Vbž•´’?P”i4¹h?6Vbž•´’¿P”i4¹h¿6Vbž•´’?P”i4¹h¿6Vbž•´’¿P”i4¹h?€2¥žÐ›¿—«›äGŒ?2¥žÐ›?—«›äGŒ¿€2¥žÐ›¿—«›äGŒ¿€2¥žÐ›?—«›äGŒ?~„ÖÆG¿cJè3ñ>BvŒ@B?€€{"E": 0.24578475916666687, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333}{} ?£™A«KŒ?B@ŒvB@–<~³•-]@š`JKM ÜÜ#M 6d56c11deab53176a29f91f976cf013e ôô  systems ðøð O  âúîâ  Si_rate  Au_rate E  ÇñÜÇ Si_rate?ÕUUUUUU Au_rate?åUUUUUU  E?Ïußÿ<ïà óó version9 ÜÜ#M 6d56c11deab53176a29f91f976cf013e ôô  @5ST`®eD öö  yangxb øø vasp õûõO  ãïûã Si_rate Au_rate E  ãïûã Si_rate Au_rate E