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_indexsystemsCREATE INDEX username_index ON systems(username)H #aindexctime_indexsystemsCREATE 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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-A indexsqlite_autoindex_systems_1systems c c ( M|, {,l g 348eb2e84947222672612e79c2537635@7~n!@9-(hecc/ / / / / / / / / / / / / / / / / / / / / / / / / / / / / / / / / / / / / / / / / / / / / kHc@%P6e@h'@kу@k@b('&@LTo lU@ p@rm&@hnU@%䃞M@/$&@v!@k@b('&@h $@"l@1߄B&@xc$@%P6e@h'@HȰw'@iƢd@ZBs&@㈵`*@"l@1߄B&@6}?V??5^I<"@HȰw@:p@˹W="@Δ@Ac]@)D/3"@S:@V??5^I<"@)d@al!A @=,Ԛ="@LTo lU@^2@H-"@hnU@BL?C5v*"@x#!@al!A @=,Ԛ="@ $@Ac]@)D/3"@HȰw@Gz?K@@scz@7A`@Pps@ 8*5@ͪ@vv@Ƨ ?RDU@hnU@yt@wW@!@ 8*5@ͪ@| !@Ƨ ?RDU@~n$@scz@7A`@HȰw'@T@4@(@ꭁR@{>@HȰw@ R@{>@HȰw@ {>@hnU@ꭁR@{>@g!@ R@{>@HȰw@ {>@(rw?ꭁR@{>@HȰw@ R@{>@ {>@(rw? W?*-9?HȰw@ W@*-9?D!T@g͵@*-9?(@ W?*-9?+ٱw@ W@*-9?LTo lU@g͵@*-9?hnU@ W?*-9?g!@ W@*-9?F%u$@g͵@*-9?HȰw@?F@%䃞-+@g!@ g@h|@ ;@@[{"name": "FixAtoms", "kwargs": {"indices": [27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44]}}]vasp{}]q]"ݥh'@jc? c?8ӅXQW99 -]? ̶ֈ`<<~Ka? Y?y:Wu?8ӅXQ?W99 -]?\Y"d Kt?O#-#l?h?'@jc? c? Y,Ee?0&N?\Y"d? Kt?O#-#l?cyW=`^?