SQLite format 3@ .° ø° ?É í ^ é B • 8â˜Eì¢d°\%/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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)‡etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems  h h‰'M † † l 3eaffa25fdc04484c340eb369021389e@5STP!«@8ßpÂZ?»yangxbOOOOOOOOOOΞvøë@%@M-[+@$@³{ò°Pëó¿õ¹ÚŠýe @$@ê K< ìó¿ƒn/iŒ@$@[Ó¼ã@ÚÄÉýû?$@CâKú@Wx—‹øNõ?$@ûyS‘ Ã@}yöÑ)@$@¾¼ûèÔ׿ãÌ#0ù?$@ðPè9@©‡htÑ@$@HŠÈ°Šw À¦¸ªì»2!@$@€$´å\Š+@$@Tƿϸpõ?§–­õE @$@» )?©võ?Ñ?ÁÅŠº @$@ˆht±sÀxÑWf,@$@ŸY ¦6@OuÈÍpƒ@$@Ûù~j¼t@ÁÿV²c#÷?$@qr¿CQ @î±ô¡ ê @$@Îeh‘î$@”'ÑG¾¥¾Ex~ÈîÀ!vd´§ "@4@vasp{}ÀM×%^ÀM߬€§f$ -ëþ±P?0žACÿW¿€†7kð¾*G?ò˜Êø÷Y?€cÓJ!K\¿Öÿ9Ì—'¿€ŸËÔ$xCj?d¬6ÿ¯:‚¿€@4óäšy?“þ^ š}?Í®{+ƒ¿×h9ÐCm[?J]2Ž‘ìQ?ªî‘ÍUó\?€ \âÈa¿íµ ÷Æ?ʤ†6P?ƒMGÅÿ]¿€€€¯ÒÝu6ä¿1%’èet?€¼yªCn†;¿å ZHÀè‚¿%= ­N΀?¸æŽþ—kq?qW¯"£b¿íò­ëz?ʉvR~r¿4…Îkìu¿$*T7{?j‰•ÑÈçU¿ý°“»jç¾ý°“»jç¾_Ás¬?ç@?€€{"E": 0.30283289000000035, "Au_rate": 0.625, "Si_rate": 0.375}{}?ƒ`n¥Áh?@ç?¬sÁ_@¤â˜êÜÇ@ ´Yô (x ÜÜ#M 3eaffa25fdc04484c340eb369021389e ôô  systems ðøð O   âúîâ  Si_rate  Au_rate E  ÇñÜÇ Si_rate?Ø Au_rate?ä  E?Óa3­° óó version9 ÜÜ#M 3eaffa25fdc04484c340eb369021389e ôô  @5STP!« öö  yangxb øø vasp õûõO  ãïûã Si_rate Au_rate E  ãïûã Si_rate Au_rate E