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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems d(MT< h @Z #M 3d986f42e3ef067323b2f524440c7a43   systems  /H    ads_site# plane_index ! Dipole_val  distance ads_E  atom_E  slab_E str_E  ads_site0t rr# plane_indexn! Dipole_val?߄?p distance?KhH ads_E[ atom_EaX slab_EfPH str_EgR[BE  version9 #M 3d986f42e3ef067323b2f524440c7a43   @7~ d  hecc  vasp /   ads_site#plane_index!Dipole_val distance ads_E atom_E slab_E str_E   ads_site #plane_index!Dipole_val distance ads_E atom_E slab_E str_E*oG8@̒5'@cZB>h @([Z @̒5'@ \ @8gDio`'@>"D]@Z*oG8@̒5'@>"D]@([Z @̒5'@Y@8gDio`'@]P߲@䃞ͪ@'kC4J$@ u@M@d`$@]P߲@ $@'kC4J$@*t^c@?W2ā$@*t^c@M@($Y$@*t^c@q@$@W2ā$@]]. @䃞ͪ@'kC4J$@72! @M@d`$@]]. @ $@'kC4J$@(rw?n@H0[G!@(rw?㈵ @H0[G!@(rw?5!@+g @@{L!@+g @bod @{L!@@ٔ+K @Ҥd!@ZGUD]@@{L!@ZGUD]@bod @{L!@Uk@Ҥd!@R~Rӱ@@@@M@@e@R~Rӱ@ +$@@*t^c@wkF}@0L F@*t^c@M@1ZGU@*t^c@ۿҤ$@0L F@ % @@@^x @M@@e@ % @ +$@@(rw?@ʦ\@(rw?  @ʦ\@(rw?ʦ\@KqU @@ʦ\@KqU @  @ʦ\@KqU @ʦ\@J_{f@@ʦ\@J_{f@  @ʦ\@J_{f@ʦ\@D!T@Ji@ v@D!T@M@ v@D!T@u$@ v@*t^c@Ji@ v@*t^c@M@ v@*t^c@u$@ v@5l/" @Ji@ v@5l/" @M@ v@5l/" @u$@ v@(rw?@A}˜.K@(rw?  @A}˜.K@(rw?A}˜.K@KqU @@A}˜.K@KqU @  @A}˜.K@KqU @A}˜.K@J_{f@@A}˜.K@J_{f@  @A}˜.K@J_{f@A}˜.K@D!T@Ji@IF?D!T@M@IF?D!T@u$@IF?*t^c@Ji@IF?*t^c@M@IF?*t^c@u$@IF?5l/" @Ji@IF?5l/" @M@IF?5l/" @u$@IF?g!@(@߉Y/"@@[{"name": "FixAtoms", "kwargs": {"indices": [37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72]}}]vasp{}gR[KgT#EPN?Mqj?(1klMqj(1kl겘|\[?jMBwIQc?}zVh?jMBwIQc}zVh?8b0&~jM?BwIQc?}zVh?jM?BwIQc}zVh?8b?0&~&P"M?Ǻf?$D2i:-PlM&P"M?Ǻf$D2DAc&q?f.pyy?B_zsp?DAc&qf.pyy?&P"MǺf?$D2i:-?PlM&P"MǺf$D2BDQi[BDQ?i[Ap-N?[a/=?8fٓ< x'n?[a/=?8fٓnKs[a/=8fٓ< x'n?[a/=8fٓnKs`_MQ*3ho?.2R4Jg?`_MQ?*3ho?lE?4 Q?鲘||?lE4 Q?`_?MQ*3ho?.2R?4Jg?`_?MQ?*3ho?b%?ΤM=b%ΤM=RI&̿r#D?eC1ZGU?r#D?eC?1ZGU?*PÄ?V%}?r#DeC1ZGU?r#DeC?1ZGU?*PÄV%}? Lnh?zƾdV?jTq?#1A Š6ُT Lnh?zƾdVjTq?$cqX;ۣ?m{$cq?X;ۣ? LnhzƾdV?jTq?#1A Š?6ُT LnhzƾdVjTq?GTn.?@пGTn.@п Wпg8 pF%uk?r{Ͽg8 pF%ukr{Ͽbg }"пg8 p?F%uk?r{Ͽg8 p?F%ukr{Ͽbg }?"пמY"? ab?%4?U~7/N|?מY"? ab%4?#Er#0?7Ӂ?#Er?#0?מY" ab?%4?U~?7/N|?מY" ab%4?N39v?.RkTp?R,)R?>tva{"str_E": -186.57364, "slab_E": -183.62805, "atom_E": -0.83008219, "ads_E": -2.1155078100000098, "distance": 1.89341, "Dipole_val": 0.492432, "plane_index": 110, "ads_site": "0t"}{}I?NP?v93N@ -@rl"h