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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems ?(MT<CUyhecc>:u?&1 @P3#@=;k?M@I&#@>:u?Z_$?P3#@E@ܝ.4 @^c#@E@ #M 186b1ce402654f7fe7fe0c8b69d96b14   systems   H   ads_site# plane_index ! Dipole_val  distance ads_E  atom_E  slab_E str_E  ads_site2f rr# plane_indexn! Dipole_val?k;< distance?TͷW ads_Ekzwjo atom_EaX slab_Eo. str_Epm  version9 #M 186b1ce402654f7fe7fe0c8b69d96b14   @7~w  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_EM@u#@E@ap%@^c#@ĔHQ@&1 @P3#@e6$#G@M@I&#@ĔHQ@Z_$?P3#@ rh?G|?4S @ rh?< @ ܺ @ rh?:dw/"@ ܺ @ @G|?Op @6$#g @(~k@'XQ @6$#g @1"@'XQ @^o%@G|?Op @=-@(~k@'XQ @=-@1"@'XQ @( ?4 %@y;i+@( ?&O @y;i+@(XQ?M@H.!=@E@s%@ϠA@E@R" @ϠA@E@M@xWfL@=$@@4 %@y;i+@=$@@&O @y;i+@j@+0D@M@H.!=@ rh?G|?|?5^@ rh?W 3@lxz,#@ rh?-C&"@lxz,#@9⪲ @G|?V '@ @'o|@\C-@ @Dio)"@\C-@%&@G|?V '@L@'o|@\C-@L@Dio)"@\C-@?(,) @~7@ ?M@e1@?j%@~7@E@n' @pΈ@E@M@%1 @E@ %@pΈ@)D/C@(,) @~7@E@M@e1@)D/C@j%@~7@ rh?G|?OIҵ @ rh?u@OIҵ @ rh?( ."@OIҵ @ٱ׵ @G|?OIҵ @ٱ׵ @u@OIҵ @ٱ׵ @( ."@OIҵ @K;#@G|?OIҵ @K;#@u@OIҵ @K;#@( ."@OIҵ @ 1?G| @ 1? 1?M@ 1? 1? 1?E@G| @ 1?E@M@ 1?E@ 1?gH@G| @ 1?gH@M@ 1?gH@ 1? rh?G|?ek}? rh?u@ek}? rh?( ."@ek}?ٱ׵ @G|?ek}?ٱ׵ @u@ek}?ٱ׵ @( ."@ek}?K;#@G|?ek}?K;#@u@ek}?K;#@( ."@ek}? rh?G|? %@1@C%@\n0Ե9@[{"name": "FixAtoms", "kwargs": {"indices": [45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71]}}]vasp{}pp_֪Ff`X|{?+d?Z H*Ŏơ~WXyVr?f`X|{?+dZ H fh_? 0*hIZw>4aX 0*hIZw?>4aXX|[T?%Ί>_? 0*h?IZw>4aX 0*h?IZw?>4aXkC8SmO?9 h?kC8SmO9 h?qnC?'_{\5Q?N#Edx?\5QN#Edx?!k^ukC8S?mO?9 h?kC8S?mO9 h?qnC'_{| ^p }?inKx }inKx~[~lbA QAglFd?fLgA?AglFdfLgA?~[~lb?A QAg?lFd?fLgA?Ag?lFdfLgA?B?,Ip`?:8؛H8fٓl%2r?B?,Ip`:8؛Hf|ew{Vp?f|e?wB,Ip`?:8؛H8fٓl?%2r?B,Ip`:8؛HʿHg`e?]C먿Hg`e]C먿L:?J ,À%W?.Y&?$&ݖȥÀ%W?.Y&$&ݖȥL:J ,À%W.Y&?$&ݖȥÀ%W.Y&$&ݖȥt~8Վ|?m?3ֿzLxE(&ٿt~8Վ|m?3ֿ arnRX;׿ƟlXؿ ar?nRX;׿t~?8Վ|?m?3ֿzLx?E(&ٿt~?8Վ|m?3ֿ3?q]P?oӟH?q]PoӟH? fLg? 8?c3?m?1е/?c3?m1е/? fLg 8?c3m?1е/?c3m1е/?whh?Q⋺́?ZAUz?*$f?ˮ/{"str_E": -257.85134, "slab_E": -252.09409, "atom_E": -0.83008219, "ads_E": -4.927167809999999, "distance": 0.916602, "Dipole_val": 0.60684, "plane_index": 110, "ads_site": "2f"}{}I?hhw?̺Q@5-X*@e