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 bb(M|,{,li df5df4a1f64349971de39555ab5119cb@7~%@9hecc/////////////////////////////////////////////HȰw@5)^R@N@3+@0[w@,eXW@JY&@ $(~y@,`W@o1 '@HȰw@G`๧?n2d"'@hnU@EX@t@HȰw@ R@{>@HȰw@{>@hnU@ꭁR@{>@g!@ R@{>@HȰw@{>@(rw?ꭁR@{>@HȰw@ R@{>@{>@(rw? W?*-9?HȰw@ W @*-9?D!T@g ͵@*-9?( @ W?*-9?+ٱw@ W @*-9?LTo lU@g ͵@*-9?hnU@ W?*-9?g!@ W @*-9?F%u$@g ͵@*-9?g!@g@h|@;@@[{"name": "FixAtoms", "kwargs": {"indices": [28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45]}}]vasp{}]i9Tq]H0uْUA?Gǁw?a+eYصݒL?*4P?K8< LuK?2ZGUD}?f.pyI?`?yؘQr„Ѭl?K8c?0*ua2U0*C?1]aH?*5{hNC]? C*q] iTd+5\ul?c wAth?5Yq3ySq^-wf|? ^)p?iR ?{GzT? w?0*DfR@ڏo +Eq㊋?ms{{GzT w?0*DY+x;.|,'?^-wf| ^)p?iR ?"kv?a?Y+x?;.|,'?IrS?;G?U+~efby'Lip[{͍ K?4jIrS;G?U+~ƻ#cZPۆ(9x&SQG? @MDN_,g?[?ƻ#c?ZPۆ(9x&ip[{?͍ K?4j]Zv?wբw?st[L+p>?"{"str_E": -118.56892, "slab_E": -116.31755, "atom_E": -0.299, "ads_E": -1.9523700000000086, "distance": 2.03293, "Dipole_val": -3.17989, "plane_index": 111, "ads_site": "1b"}{}.?S1[?ww@]@M #M df5df4a1f64349971de39555ab5119cb   systems  /-    ads_site# plane_index ! Dipole_val  distance ads_E  atom_E  slab_E str_E  ads_site1b rr# plane_indexo! Dipole_val pj+ distance@CpuO ads_E