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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems t(MD\{\ls 1687b7f7ab75f7ec19a8a726dcbab66b@7~@9 84hecc ek}?ek}?E|'(@ek}?ek}?rKQ$@ek}?^ @3}ƅ$@ek}?x@3}ƅ$@^ @ek}?3}ƅ$@o/i@o/i@#$@o/i@ F%u@#$@x@ek}?3}ƅ$@ F%u@o/i@#$@ F%u@ F%u@#$@#@l[@~!@#@#@~!@?RDU|@oG8-x@ cZB.!@oG8-x@h? cZB.!@oG8-x@?RDU|@ cZB.!@oG8-x@oG8-x@&1,!@l[@l[@~!@l[@#@~!@h?oG8-x@ cZB.!@ek}?ek}?Fžv@ek}?$@9?0 @oG8-x@ v@0 @oG8-x@oG8-x@B5v@D!T@D!T@Ӽ@D!T@B@Ӽ@'>9?oG8-x@0 @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\?1@1@4}=@[{"name": "FixAtoms", "kwargs": {"indices": [37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54]}}]vasp{}h0?#>? fh?#> fh#>? fh#> fh>!;oc?]~p?>>!;oc?]~p>>!;oc?#? Xrd Xrdy H? Xrd Xrd?y H?]~p?>>!;oc?;~>?;~>?ϼe?b!{"str_E": -193.50736, "slab_E": -190.59214, "atom_E": -0.29474202, "ads_E": -2.620477980000005, "distance": -2.06764, "Dipole_val": -0.73187, "plane_index": 100, "ads_site": "0t"}{}7?t*#?>~;@ ^@[ #M 1687b7f7ab75f7ec19a8a726dcbab66b   systems  6   ads_site# plane_index ! Dipole_val  distance ads_E  atom_E  slab_E str_E  ads_site0t rr# plane_indexd! Dipole_valkz]z distance6& ads_E( atom_E *  slab_Egϕ str_Eh0