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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems r(MD\{\lo 542713337f68d2f347d377dbf10377b8@7~O@8Vhecc 1@ @-l'@q@n4@ m9'@pq@hs@ m9'@~n@JR@ m9'@ 1@Ǻ@p:'@!@hs@ m9'@\C!@JR@ m9'@x]$@n4@ m9'@ۧ1'@@[%X?%P#@ 1@n @%P#@OXe@; @'X#@Ac]@[%X?%P#@!J@-s, @.Q#@ 1@`@.Q#@ 1@ x#?'X#@£"@-s, @.Q#@#$@; @'X#@al!A?䠄?|S@;Tގ@K7@J)@ 1@7d@|S@ 1@Pf?J)@mscz’@K7@J)@0"@cbqm@=;k@^2@䠄?|S@ 1@׆q@=;k@rCQ!@cbqm@=;k@ 1@ @^2@R @mscz@Oe@6T@-[닄@Oe@c AJ@vöE@Oe@ 1@Ǻ@iƢ@]zk"@-[닄@Oe@Y4 !@vöE@Oe@E_$@mscz@Oe@Hm~@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@{,}? 1@ @Ĭ*@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{}h|Th KpHS?VSbR?. LT?AA)Z7yZ. LT?1Y?*g\8@?. LT?kC8S?AA)Z7?yZ. LT?1Y*g\8@?. LT?HSVSbR?. LT?稣jdw?W2KE+Bq2[?E+Bq@fg;5 ĭ(? FW?2KE+Bq??̔>IaLcZQfIaLc~jt8 F?̔>IaLc@fg;5? ĭ(? F<2VW]_ P'eRC?ʩajKMhY@?}V_ `?'eRC?hYP}VʩajKM?hY@?}V_>Y1\ݾ>>s֧\<2VW]?_ P'eRC?>s֧\_>Y1\>>>s֧\vk DJyL>@5_%_pDk<~jtH?@5_%_J>@5_%_^SOjkD0.}ڮp`9zڮ؀?`9zJ yk+,_?ijkD0.}?ڮp`9zh z?խn?2nխ~2n Eoih zխn?2nJ yk?+,_?i|?Vp?,zM?\qqTn?#k "zh ?V횀,zM?#k "?h ?\qqTn#k "zh ?T^ PZ?cyW=`N@شR?|Vp?,zM?aod^?@شR?T^ PZcyW=`N@شR?|yjOB~?jOB~?ST WtW?T {"str_E": -195.88526, "slab_E": -192.84492, "atom_E": -1.1170954, "ads_E": -1.9232445999999863, "distance": 1.5186, "Dipole_val": 0.280668, "plane_index": 111, "ads_site": "0t"}{}7?y|?~BәOj@ #@lA #M 542713337f68d2f347d377dbf10377b8   systems   6   ads_site# plane_index ! Dipole_val  distance ads_E  atom_E  slab_E str_E  ads_site0t rr# plane_indexo! Dipole_val?vB( distance?L/{J# ads_EŜ!3V1 atom_Eߟm1O slab_Eh  str_Eh|T ǎ  version9 #M 542713337f68d2f347d377dbf10377b8   @7~O  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