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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems u(MD\{\lu 85a23a336549b60901eae776766d458a@7~m@8v{hecc @ܵ|@x]'@W2đ@>@ԕ'@6 r@מY"?ni5$'@Ե@-l@5 S'@ҩ+@>@ԕ'@s.Ue!@Gŧ@(\'@&S?ܵ|@x]'@v$@UގpZ@K7'@Oe#'@Gŧ@(\'@6 r@t//?ط#@&:@6׆ @4F#@#bJ$@ K<@䠄#@s@=Ͻ?F6#@Ե@1 @KqU#@|,}@ K<@䠄#@}@=Ͻ?F6#@sFZ*!@6׆ @4F#@v$@n@c]K#@Wc#?rPLۿ?hUM@6 r@E@xZ@'$@G=D;@m@&jj@rPLۿ?hUM@K@A 3m@K@OIҵ@c&@\m@Ե@/$@Ե@E>@ѩ+@}"O@o@,g~5@)D!@@[[@R,?B=@ vö@oG8-x@ @/4i@|~!<@@[[@6 r@9b->?镲 @ 1@ @镲 @S!u@UD@镲 @oG8-x@9b->?镲 @Ե@ @镲 @ 1@UD@镲 @ 1@9b->?镲 @:H!@ @镲 @v$@UD@镲 @6 r?9b->?{,}?6 r@9b->@{,}? 1@g~5@{,}? 1@9b->?{,}?S!u@9b->@{,}?OIҵ@g~5@{,}?Ե@9b->?{,}? 1@9b->@{,}?:H!@g~5@{,}?oG8-x@&p@Fw;3/@1@ 1@9y @ ;@@[{"name": "FixAtoms", "kwargs": {"indices": [36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53]}}]vasp{}hh#)sn?X|[T7_sp?YYL/1f*5{hd< X?uoEbZ?z?Xo ZY?YL/1f*5{hH[@Y+^? e)snX|[T7_sp?h㈵>jIG9h?H[@?Y+^? eV_]U?j t?0&>?x!]EׅO]7k*G?Xj@˻p_ `5\u\?Q,b?I?$Di ?7k*GXj@˻p_ `?5\u\?Q,b?0&>x!]EׅO]fLg5x_ u?*6u![?y?mo?0*eh?mf*T7S?nHJzH?*6u![y?mo?I%r9?HSȕzF?g\8b?MۿҤT?M7Qcg ujPmpb?I%r9HSȕzF?g\8b?mf?*T7S?nHJzH?O'S?֦6?_>Y1\=ګe,Da?2go}x:̗`_IV_1=adc#7ګe?,Da?2go}xQTEobHN&nE?̔"O'S֦6?_>Y1\=gsU?yCn+?QTE?obHN&nE?̔"^ PjT/1"|8G]? <^?fdd7i:?MG]صݒE|'fH?g,{2`? 'Xj`?8~d7i:MG]صݒE|'fHg,{2`? '|8G] <^?fdŭp5C8 Tb.A?I\߇?a@L?%FFn1@?S?C8 ?Tb.A?I\߇?rQ-";wJLIQ,?lE?`?5&b=y?rQ-";?wJLIQ,?%F?Fn1@?S?V횐H<$t?ޏT~?T~?PHW? !Yݹ>>|Ge_{"str_E": -192.86567, "slab_E": -192.84492, "atom_E": -0.0126, "ads_E": -0.008149999999992497, "distance": 3.65707, "Dipole_val": -0.00758829, "plane_index": 111, "ads_site": "1b"}{}7?|9]#?~TԽ@ #@S| #M 85a23a336549b60901eae776766d458a   systems   6   ads_site# plane_index ! Dipole_val  distance ads_E  atom_E  slab_E str_E  ads_site1b rr# plane_indexo! Dipole_valC distance@ Av6 ads_E{ atom_E_o  slab_Eh  str_Ehd  version9 #M 85a23a336549b60901eae776766d458a   @7~m  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