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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems (MT<{?:pX!@$\ @s@+ٱ!!@$\ @P6 @+ٱ!!@M֨h @:pX!@rCQ@ea@d#!@rCQ@G=D; @d#!@rCQ@ @_2ᗺ@G@vۅ@4F(@rZ| @> @BsF$@G@@H0Q @_2ᗺ@G@#^L @4F(@rZ| @@H0Q @BsF$@G@L?@@L?~k, @@6>W[?+ٱ@WI @@@WI @~k, @@Fj @+ٱ@rCQ@ؙB@e@rCQ@hHK @e@rCQ@gs@ KW[@S.@ K"Db?x #1+,OzލAi x'^+,O?zލAi? x'^j>"Dbx #1+,O?zލAi x'^N=pY7*6u!KN=pY7?*6u!Ke3Fޏ/HN=?pY7*6u!KN=?pY7?*6u!Ke3F?ޏ/H6w\*Ŏơ~G?6w\?*Ŏơ~G? tPi4h<-?p'@?֩=#jPi4h?<-?p'@?^S/?1߄B\nYk(W*6u![bD#?^S/?1߄B\?nYk(W^S/1߄B\nYk(W*6u![?bD#?^S/1߄B\?nYk(W\tz?ևFxĬ\tz?ևF?xĬk@?3PlM޿\tzևFxĬ\tzևF?xĬk@3PlM޿$W@n?a$W@naSy;iA x'o?5`i?Έ? x'o5`i?rQz0*u~ʼn?a?ƽ ?rQz0*u?~ʼn?rQz?0*u~ʼn?aƽ ?rQz?0*u?~ʼn?G,?7 ?|&z?0nB`?2E1{"str_E": -221.67917, "slab_E": -218.52697, "atom_E": -0.24284194, "ads_E": -2.9093580599999935, "distance": 1.93633, "Dipole_val": 1.28622, "plane_index": 110, "ads_site": "1b"}{}I?,G? ϖ7@Y@ąb