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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems q(MD\{\lm f5c679c16f4b0dc38f96d976237e6c73@7~(Ϋ@9&=xuheccek}?bE?}ݩ$@ek}?>M@}ݩ$@ek}?OIҵ@a4$@9d@{?n$@9d@|w@n$@鷯@OIҵ@P>$@<;@{?n$@<;@|w@n$@9z@OIҵ@P>$@ȓk@9d@S"!@ y@6 r@E!@ȓk@m@S"!@oG8-x@|DL$z?_3!@oG8-x@6 r@z;!@oG8-x@+w@_3!@VHI@9d@S"!@x s?6 r@E!@VHI@m@S"!@ek}?W[?QfL2@ek}?3y@QfL2@ek}?OIҵ@@@"2@#?[닄@@"2@GȰ@[닄@72@OIҵ@PLۿ@/ Ҭ@#?[닄@/ Ҭ@GȰ@[닄@s@OIҵ@PLۿ@r߉@#-#F?@@6 r@a2U0*@r߉@ƊLÐ@@oG8-x@ F%uz?dz@oG8-x@6 r@g?R@oG8-x@@dz@J$(@#-#F?@6@6 r@a2U0*@J$(@ƊLÐ@@ek}?ek}?_@ek}? 1@_@ek}?OIҵ@_@ 1@ek}?_@ 1@ 1@_@ 1@OIҵ@_@OIҵ@ek}?_@OIҵ@ 1@_@OIҵ@OIҵ@_@6 r@\wT\?6 r@6 r@\wT\?6 r@oG8-x@\wT\?oG8-x@\wT\?oG8-x@6 r@\wT\?oG8-x@oG8-x@\wT\?\wT\?6 r@\wT\?oG8-x@\wT\?ek}?6 r@-`'@1@1@4}=@[{"name": "FixAtoms", "kwargs": {"indices": [36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53]}}]vasp{}h{'2h{GolXSYT^(`;XlXSYT?^(`;XL0l"3cf?/nR%2"3cf?/nR?%2O!WY@?֎ut|"3cf/nR%2"3cf/nR?%2O!WY@֎ut|ȗPaFn1@}V?n2 n`?qj\ȗPaFn1@?}V? Z+\ Eo(֩=#q Z+\? EoȗPa?Fn1@}V?n2 n`qj\ȗPa?Fn1@?}V?:YXh?+~7e:YXh+~7e.r6w\F?{&J ˟o f6w\F?{&J? ˟o f/n2?^S_?6w\F??{&J ˟o f6w\F??{&J? ˟o f/n2^S_?() t?rfB?f.pyI?>trfB?() ?a|?dg?8 {"str_E": -195.84853, "slab_E": -190.59214, "atom_E": -1.8878972, "ads_E": -3.36849280000001, "distance": 1.55504, "Dipole_val": 0.900383, "plane_index": 100, "ads_site": "2b"}{}7?޴?>0 @ ^@ _Մ #M f5c679c16f4b0dc38f96d976237e6c73   systems   6   ads_site# plane_index ! Dipole_val  distance ads_E  atom_E  slab_E str_E  ads_site2b rr# plane_indexd! Dipole_val?[ distance?q ads_E Zf} atom_E4ӱ\  slab_Egϕ str_Eh{'(b  version9 #M f5c679c16f4b0dc38f96d976237e6c73   @7~(Ϋ  hecc  vasp    ads_site#plane_index!Dipole_val distance ads_E atom_E slab_E str_E   ads_site #plane_index!Dipole_val distance ads_E atom_E slab_E str_E