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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)‡etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems  ¯ ¯ŒN'ML‰ ‰ l; 34a7313f124369f951eb9e79d0d7621d@5ST]*öè@9 Rž³ÄNyangxbOOOOOOOOOOOOOOOOòÒMbÈ!@F±ÜÒj8 @$@òÒMbÈ!@ú'¸XQS(@$@À[ Añc@¿·éÏž@$@À[ Añc@ÜFx ¤õ?$@'†§WJü?¿·éÏž@$@'†§WJü?ÜFx ¤õ?$@Zõ¹ÚŠ} @F±ÜÒj8 @$@Zõ¹ÚŠ} @ú'¸XQS(@$@z¥,CÛ @Ö¸ÇÒ @$@®¶bÙ=@ lÊÞE$@$@ðHPüØ@ lÊÞE$@$@}?5^ºÉ@Ö¸ÇÒ @$@CsFZªð?™ðKý¼9)@$@CsFZªð?k‚¨û¤@$@fN—ÅÄ&@¨ŒŸqáì?$@fN—ÅÄ&@]Pß2§k@$@Îüj<#@¨ŒŸqáì?$@Îüj<#@]Pß2§k@$@æèñ{@™ðKý¼9)@$@æèñ{@k‚¨û¤@$@û?‡ùòÂ@ lÊÞE$@$@¼³vÛ…æØ?Ö¸ÇÒ @$@rö´Ãß@Ö¸ÇÒ @$@'Nîw(Š$@ lÊÞE$@$@~?ý³[Q%@€¬U×{Ó+@4@vasp{}ÀUý+QRFÀVƶ’ù—É8F²G¨y¿§@fgÑ;E¿€É8F²G¨y¿§@fgÑ;E?€É8F²G¨y?§@fgÑ;E?€É8F²G¨y?§@fgÑ;E¿€É8F²G¨y?§@fgÑ;E?€É8F²G¨y?§@fgÑ;E¿€É8F²G¨y¿§@fgÑ;E¿€É8F²G¨y¿§@fgÑ;E?€zƾdãÁf¿€zƾdãÁf?€zƾdãÁf?€zƾdãÁf¿€êÐéy7D¿ÜN ^ôU¿€êÐéy7D¿ÜN ^ôU?€êÐéy7D?ÜN ^ôU?êÐéy7D?ÜN ^ôU¿êÐéy7D?ÜN ^ôU?€êÐéy7D?ÜN ^ôU¿êÐéy7D¿ÜN ^ôU¿€êÐéy7D¿ÜN ^ôU?€—¤¤‡¡u¿—¤¤‡¡u?—¤¤‡¡u?—¤¤‡¡u¿™#Cj2ô>íviR›ÚѾøG%Zè-B?€€{"E": 0.2753049645833334, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333}{}?yËTø"+Ô?B-èZ%Gø@¦‚Sš\ò@ª`JKM ÜÜ#M 34a7313f124369f951eb9e79d0d7621d ôô  systems ðøð O  âúîâ  Si_rate  Au_rate E  ÇñÜÇ Si_rate?ÕUUUUUU Au_rate?åUUUUUU  E?Ñž˜¶Óõp óó version9 ÜÜ#M 34a7313f124369f951eb9e79d0d7621d ôô  @5ST]*öè öö  yangxb øø vasp õûõO  ãïûã Si_rate Au_rate E  ãïûã Si_rate Au_rate E