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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems s(MD\{\lq 929485a6b94c9049317993438b8d09fb@7~/=@8qhecc;SF@t{Ic@D(@mnLO@뭁@ޓZ'@OIҵ@ N]y@D(@Ե@V@ޓZ'@ޓZ@뭁@ޓZ'@ "@!A 3@+j'@jZ_$!@t{Ic@D(@v$@ vö@+j'@E_A'@!A 3@+j'@6 r@9b->?HV#@a7l[@j'; @Aȓ#@> Y@ؙB@Aȓ#@kC@Bxq?Aȓ#@Ե@ @*<#@<1P@ؙB@Aȓ#@JOc@Bxq?Aȓ#@o!@j'; @Aȓ#@v$@UD@뭁#@?5^I?`YiR ?-@6 r@f@-@$@M-@n@p $ @?@`YiR ?-@M O@ݘ@%e @OIҵ@:M@%e @Ե@S㥛?p $ @@ݘ@%e @ !@n@p $ @#@'X@~ @W`V@[ A@܀#@OIҵ@-σ@~ @Ե@VC@܀#@#-R@[ A@܀#@k@h㈵>Yw@"!@'X@~ @oG8-x@9EGr@Yw@h㈵?h㈵>Yw@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$@UD@镲 @6 r?9b->?{,}?6 r@9b->@{,}? 1@g~5@{,}? 1@9b->?{,}?S!u@9b->@{,}?OIҵ@g~5@{,}?Ե@9b->?{,}? 1@9b->@{,}?:H!@g~5@{,}?6 r@9b->?z6>W;+@1@ 1@9y @ ;@@[{"name": "FixAtoms", "kwargs": {"indices": [36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53]}}]vasp{}hb3hЀ f$Di-?]/M!?O;5YNk3 Z?ِfOl=C8fs fh<1O;5YNِf_?l=C8fsk3 ZِfOl=C8fsW;st?HgB;Y}$Di-]/M!?O;5YNHw?B;Y}W;stHgB;Y}#n?JbI_?hnlcxgT'0mp?Fn1 ?cxgT]/MaD?{k?cxgTD0.sn?'0mpFn1 ?cxgT]/Ma?D?{k?cxgTJbI_hnlcxgT"VSy?m?$W@n?}$W@n?9?qu8Ci?5?rSym?$W@n?8fٓ?m\wِfP?X|[TfLg1_% $?,\n5oh`X|[T>?m\?wِfP?X|[TBiޑyxGo|4 #Ƥg?48EG?4 zp̂Z H_4 5#Ƥg48EG?4 zp̂?Z H_4 y?xGo|4 %s3'_{U@)?'_?U@)?HȰ7? puL'?3?'_{U@)?PoWmUb~V)?d`Tr?~V)?/H?L'?Po?WmUb~V)?HȰ7 puL'?*T}lg >x?lg >x?"qY?>h{"str_E": -198.30775, "slab_E": -192.84492, "atom_E": -0.94462243, "ads_E": -4.518207569999997, "distance": 1.60231, "Dipole_val": 0.764225, "plane_index": 111, "ads_site": "3h"}{}7?(;?x> gl@ #@+ #M 929485a6b94c9049317993438b8d09fb   systems   6   ads_site# plane_index ! Dipole_val  distance ads_E  atom_E  slab_E str_E  ads_site3h rr# plane_indexo! Dipole_val?t# distance?π3 ads_EV+ atom_E:X}` slab_Eh  str_Eh+  version9 #M 929485a6b94c9049317993438b8d09fb   @7~/=  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