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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)‡etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems  h h‰'M † † l 7233a6a4025980009b0e51a39e8cdf29@5STPL‹-@8ûzp¡áJyangxbOOOOOOOOOO#-•·#À K< lj@$@UÙwEð¿@K°8œùÕ@$@#-•·#@€$@1%’èåÀ«²ïŠàŸ@$@?o*Raìó?S‘ c A@$@öóåå@€$@$@[ë‹„¶œ×?ætYLlÞ@$@ç:´TÞò?F”ö_˜@$@½5°U‚Åø¿|í™% @$@šë4ÒRy @°¶-Êl@$@óåØg@n†ðùa@$@öÑ©+Ÿ¥@9œùÕ þ?$@mâä~‡"@Ø»?Þ«ö@$@Pª}:s@€$@‰ «x#sõ¿ú~j¼t“@$@ŒÃÓ î$@€õºÓ îÀky>3 "@4@vasp{}ÀM×pòüÀMßú–ÊtÞèc> Ði¿+l¸ [v?Þèc> Ði¿+l¸ [v¿€<ôÝ­,Ñy?Ê©ajK=¿aÃÓ+eI?Ê©ajK=¿aÃÓ+eI¿€ÀnÝÍSM?€€1AG«Zr?“RÐí%q¿€„*5{ X?„aÀ’«x?€ÒQf`x¿,õ,å}\¿ÒQf`x¿,õ,å}\?€1AG«Zr?“RÐí%q?„*5{ X?„aÀ’«x¿€ÅW;ŠsÔq¿+Úç6á~¿R~RíÓ?ÅW;ŠsÔq¿+Úç6á~? öÔ“÷ó¾ öÔ“÷ó¾d;¼Ao??€€{"E": 0.30267472937500006, "Au_rate": 0.625, "Si_rate": 0.375}{}?Ô+Í̽??oA¼;d@£fw4@ ´Yô (x ÜÜ#M 7233a6a4025980009b0e51a39e8cdf29 ôô  systems ðøð O   âúîâ  Si_rate  Au_rate E  ÇñÜÇ Si_rate?Ø Au_rate?ä  E?Ó_Óÿq óó version9 ÜÜ#M 7233a6a4025980009b0e51a39e8cdf29 ôô  @5STPL‹- öö  yangxb øø vasp õûõO  ãïûã Si_rate Au_rate E  ãïûã Si_rate Au_rate E