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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)‡etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems   ‡^&Ml„L„Ll= 2a59bd7c51c921f93ef2e8281b47300c@5ST`ÍHá@9$½" 3yangxbOOOOOOOOÌ(–[Z ú?Ü)¬ÿ3@9(a¦íÿ#@AŸÈ“¤ë@ÿx¯Z™P@9(a¦íÿ#@íž<,Ô:@!ÈA 3mð?9(a¦íÿ#@ãüMh@M„ OO@9(a¦íÿ#@ãüM(Äó?ðĬC9Ý?9(a¦íÿ#@Wx—‹ø> @»òYž—@9(a¦íÿ#@MÖ¨‡¨@OuÈÍpà @9(a¦íÿ#@é·¯çŒ @FÓÙÉà@9(a¦íÿ#@|'f½Êé?á].â;‘@9(a¦íÿ#@B²€ Ü!@PÂLÛ¿²@9(a¦íÿ#@©Ù­Àð@h†¬@9(a¦íÿ#@•ŸTûtü@9—⪲oõ?9(a¦íÿ#@ ŵ‹}·"@@˜úÊšj@4@vasp{}ÀF*TŸêk™ÀF0¼äø<½'iþ˜Ö¦?õg?RD†•?€'iþ˜Ö¦¿õg?RD†•¿€'iþ˜Ö¦?õg?RD†•¿€'iþ˜Ö¦¿õg?RD†•?ài2ãm¥w¿/ûu§;OŒ¿ài2ãm¥w?/ûu§;OŒ?ài2ãm¥w¿/ûu§;OŒ?ài2ãm¥w?/ûu§;OŒ¿€¡‚à "R“?!Z+Úç†?¡‚à "R“¿!Z+Ú熿¡‚à "R“?!Z+Ú熿¡‚à "R“¿!Z+Úç†?€ù†‘o"¿æž¡H‹ûî¾ùŸB¡&B?€€{"E": 0.24590303833333346, "Au_rate": 0.6666666666666666, "Si_rate": 0.3333333333333333}{} ?—C€ÄD;g?B&¡BŸù@–<øÅÍÕ@š`JKM ÜÜ#M 2a59bd7c51c921f93ef2e8281b47300c ôô  systems ðøð O  âúîâ  Si_rate  Au_rate E  ÇñÜÇ Si_rate?ÕUUUUUU Au_rate?åUUUUUU  E?ÏyÀ1ÐyK óó version9 ÜÜ#M 2a59bd7c51c921f93ef2e8281b47300c ôô  @5ST`ÍHá öö  yangxb øø vasp õûõO  ãïûã Si_rate Au_rate E  ãïûã Si_rate Au_rate E