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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems s(MD\{\lq 5c3e045caffcd9dd9564c1443ddb08b4@7~ Z@8ߨzhecc//////////////////////////////////////////////////////{?{?k)Ƴ'@7v?D!T@~!<ژ'@{?ME*-@k)Ƴ'@D!T@7v?~!<ژ'@D!T@D!T@>x'@D!T@*5{U@~!<ژ'@ME*-@{?k)Ƴ'@*5{U@D!T@~!<ژ'@ME*-@ME*-@k)Ƴ'@5l/R@.9#@tv28@.9#@9#@qa@qa@2d#@qa@ m9@2d#@5l/R@.9#@ m9@qa@2d#@ m9@ m9@2d#@tv28@.9#@??_@$]3f?D!T@Jvl@?sR@_@D!T@$]3f?Jvl@D!T@D!T@s/@D!T@DUY@Jvl@sR@?_@DUY@D!T@Jvl@sR@sR@_@>"D}@*i@Mt@*i@T:Xp@';@';@Rr@';@;1p@Rr@>"D}@*i@;1p@';@Rr@;1p@;1p@Rr@Mt@*i@w?w?R!5 @w?D!T@R!5 @w?LTo lU@R!5 @D!T@w?R!5 @D!T@D!T@R!5 @D!T@LTo lU@R!5 @LTo lU@w?R!5 @LTo lU@D!T@R!5 @LTo lU@LTo lU@R!5 @HȰw@^o%;?HȰw@^o%;?^o%;?HȰw@HȰw@^o%;?HȰw@HȰw@^o%;?HȰw@^o%;?HȰw@HȰw@^o%;?HȰw@HȰw@^o%;?HȰw@^o%;? 8+@g!@g!@7@@[{"name": "FixAtoms", "kwargs": {"indices": [36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53]}}]vasp{}a~1ۗa͛xa:~S?~S?cxgT?N|8G]?L0kh?~S?~ScxgT?N|8G]?L0kh?)Rbw?N|8G]L0kh?~S~S?cxgT?N|8G]L0kh?~S~ScxgT?3ۃEs?3ۃ?Es?X+t?Q+RQ+R:`4?Q+RQ+R?:`4?3ۃEs?Q+R?Q+R:`4?Q+R?Q+R?:`4?3ۃ?Es?=3=3/Cx?.H? 8KrB?=3=3?/Cx?.H? 8KrB?Q0c 8k?.H 8KrB?=3?=3/Cx?.H 8KrB?=3?=3?/Cx?t^cJpaS?t^cJ?paS?wH1@ d4ׂ[4ׂ[CR?4ׂ[4ׂ[?CR?t^cJpaS?4ׂ[?4ׂ[CR?4ׂ[?4ׂ[?CR?t^cJ?paS?p71$'c?p71$'c?8+غ_sp?'0mp71$'c?p71$'c8+غ_sp?'0m>9 _sp'0mp71$'cp71$'c?8+غ_sp'0mp71$'cp71$'c8+غR?!6X?R!6X?%Ǻ?2}?2}?Y޶?2}?2}Y޶?R?!6X?2}2}?Y޶?2}2}Y޶?R!6X?>̔?GSHPu?GSHPu?5 D?~E]{"str_E": -142.42165, "slab_E": -138.95552, "atom_E": -0.24284194, "ads_E": -3.2232880599999927, "distance": 1.75851, "Dipole_val": 1.13994, "plane_index": 100, "ads_site": "2f"}{}7?̫֔>?uPHSG@-+Jl@U2a| #M 5c3e045caffcd9dd9564c1443ddb08b4   systems   /6   ads_site# plane_index ! Dipole_val  distance ads_E  atom_E  slab_E str_E  ads_site2f rr# plane_indexd! Dipole_val?=1o distance?"a ads_E K@LL atom_Eq2C slab_Ea^Ց str_Ea~($ x  version9 #M 5c3e045caffcd9dd9564c1443ddb08b4   @7~ Z  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