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 v(MD\{\lw 5b93ac687706f4ddd343196b6085c16f@7~ _j@9&?hecc////////////////////////////////////////////////////// w?w? '@w?h:;@'@w?b('U@'@h:;@w?'@4R@4R@7'@4R@(\U@7'@b('U@w?'@(\U@4R@7'@(\U@(\U@7'@9̗'?IQ,w@+ٱ#@-C6?HȰw@ N]#@9̗'?9̗'?+ٱ#@IQ,w@IQ,w@+ٱ#@CVw@HȰw@ N]#@IQ,w@9̗'?+ٱ#@HȰw@CVw@ N]#@HȰw@HȰw@ S"#@HȰw@-C6? N]#@w?w?4 @w?_2ᗚ@n@w?GzT@n@_2ᗚ@w?n@( @( @Pf@( @hnU@Pf@GzT@w?n@hnU@( @Pf@hnU@hnU@Pf@9̗?H0[w@eNw@(>!@HȰw@؁sFv@9̗?9̗?eNw@H0[w@H0[w@eNw@&Nw@HȰw@؁sFv@H0[w@9̗?eNw@HȰw@&Nw@؁sFv@HȰw@HȰw@)^x@HȰw@(>!@؁sFv@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%;?w?w?X2ı.@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_+sJa_C3LM7qboJ?vk IboJvk IboJ?vk I9̗?9̗?/HMh?9̗?9̗/HMh?boJvk I9̗9̗?/HMh?9̗9̗/HMh?6 \^6 \^?h8enQ?Z.S\\ m6 \^6 \^h8enQ?6 \^?6 \^?h8enQ?Z.S\?\ m6 \^?6 \^h8enQ?Z.S\?\ m1zn+Q?Z.S\\ m_s`L/1g/fKvL/1g?/fKvL/1g/fKv8ӅXA?8ӅXA?a[>b8ӅXA?8ӅXAa[>bL/1g?/fKv8ӅXA8ӅXA?a[>b8ӅXA8ӅXAa[>bMb@Mb@?BD/"E?E2p?Mb@Mb@BDMb@?Mb@?BD/"EE2p?Mb@?Mb@BD/"EE2p?x`Cf/"E?E2p?Q뵿J>Lk%tĵJ>L?k%tĵJ>Lk%tĵAh:;9?Ah:;9?F@1Ah:;9?Ah:;9F@1J>L?k%tĵAh:;9Ah:;9?F@1Ah:;9Ah:;9F@13ۃ 3ۃ ?E&H?`?)AG?3ۃ 3ۃ E&H?3ۃ ?3ۃ ?E&H?`??)AG?3ۃ ?3ۃ E&H?`??)AG?/EHݶ?`?)AG?8j?tlQ{"str_E": -138.9741, "slab_E": -138.95552, "atom_E": -0.0125517, "ads_E": -0.006028299999985829, "distance": 3.56569, "Dipole_val": -0.0217529, "plane_index": 100, "ads_site": "0t"}{}7?j8?y<t@-+Jl@ #M 5b93ac687706f4ddd343196b6085c16f   systems   /6   ads_site# plane_index ! Dipole_val  distance ads_E  atom_E  slab_E str_E  ads_site0t rr# plane_indexd! Dipole_valFdh_d distance@ zd ads_Ex!uM atom_E! slab_Ea^Ց str_Ea_+a  version9 #M 5b93ac687706f4ddd343196b6085c16f   @7~ _j  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