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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems h(MT< 'Y$@k @i@T[X$@k @}"O$@T[X$@! @Ji@E>'Y$@"2" @i@T[X$@"2" @}"O$@T[X$@pWs?@37H!@4ctv?  @ڊeG!@pWs?g?37H!@PI5S @@37H!@/Q5U @  @ڊeG!@PI5S @g?37H!@J_{f@2喖@ՐG!@J_{f@  @GG!@J_{f@_vOV?ՐG!@D!T@Ji@L@D!T@3V@nض@D!T@lIF$@nض@]hӈ@Ji@,d@G=D;@@@G=D;@X9v$@@s" @Ji@,d@y]" @@@y]" @X9v$@@(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?D!T@Ji@XG.@g!@(@߉Y/"@@[{"name": "FixAtoms", "kwargs": {"indices": [36, 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]}}]vasp{}f W+fG4Р70P?Z^6s?tמy>p?aE| v?70P?Z^6stמy70PZ^6s?tמy>paE| v?70PZ^6stמyД~Pg?Uh bI/j?Д~PgUh bFu:p0s }ie0s }?ie(Bver#DV?W9i?g}EZW9i?g?}EZ(Bve?r#DV?W9ig}EZW9ig?}EZ>VfUPw?rLi?N)]b?)t^cg?>VfUPwrLi?>Vf?UPw?rLi?N)]b)t^cg?>Vf?UPwrLi?T5A}r?y"ps?Y+>T5A}ry"ps?NwxV?[[%X\h8enQ?[[%X\?h8enQ?ɑj=~os?fʉvUՔdM?Gsdh?fʉvUՔdMGsdh?ɑj?=~os?fʉvU?ՔdM?Gsdh?fʉvU?ՔdMGsdh? 8KrRk$ 5?k ;PhI{"str_E": -183.65776, "slab_E": -183.62805, "atom_E": -0.025496589, "ads_E": -0.004213410999994352, "distance": 3.51953, "Dipole_val": -0.040292, "plane_index": 110, "ads_site": "2f"}{}I?% V?t・q@ -@~uY}