SQLite format 3@ .  ? ^ B 8Ed\%/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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems f(MT< "DR?a2U0*?={.Scٕf?smB"DR?a2U0*={.Scj>"DRa2U0*?={.ScٕfsmB"DRa2U0*={.ScV횐8ikMjhAV횐8?ikcxgdNj`w oNj`?w oMnkkׄƠc :!t%L?1߄B\?2p :!t%L?1߄B\2pMnk?kׄƠc :!t%L1߄B\?2p :!t%L1߄B\2ppDk|hn? [[Y?@wpDk|hn [pDk|?hn? [[Y??@wpDk|?hn [E4frOWw,I?MӀAE4fr?OWw,I?S<2|c?At2|cAt-v2s8N gj$Di}=?W$Di}=W-v2s?8N gj$Di}?=?W$Di}?=W獓¼y?֪]C?.5Ͽ !p$p"Tο獓¼y?֪]C.5Ͽ獓¼y֪]C?.5Ͽ !p$p?"Tο獓¼y֪]C.5ϿV`v^f(7ϿhE,bпV`v?^f(7Ͽil?Nz1t^k?Nz1t?^k?J!KPH?ْUQ?,am?˸?ْUQ?,am˸?J!K?PH?ْUQ,am?˸?ْUQ,am˸?=0Qt?&Hj?9zO:S?>򚼯H{"str_E": -185.41293, "slab_E": -183.62805, "atom_E": -0.0039355698, "ads_E": -1.7809444301999868, "distance": 1.22579, "Dipole_val": -1.04315, "plane_index": 110, "ads_site": "2f"}{}I?|Si?tQ0=@ -@nо )