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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems u(MD\{\lu 39ae61a8add7d7967bd0960a9d1f9cba@7~֋@8I_4heccq]@_$\@yS'@#@ c A@Zd;O'@6 r@؞Yv?yS'@Ե@@Zd;O'@M'@@M'@6 r@9b->?ۧ1#@RDU@d# @Hm#@Hh˙@}?5^@Hm#@0du@Dio?Hm#@Ե@ @K?镲 @ 1@ @镲 @S!u@UD@镲 @oG8-x@9b->?镲 @Ե@ @镲 @ 1@UD@镲 @ 1@9b->?镲 @:H!@ @镲 @v$@UD@镲 @6 r?9b->?{,}?6 r@9b->@{,}? 1@g~5@{,}? 1@9b->?{,}?S!u@9b->@{,}?OIҵ@g~5@{,}?Ե@9b->?{,}? 1@9b->@{,}?:H!@g~5@{,}?6 r@9b->?3}ƅ)@1@ 1@9y @ ;@@[{"name": "FixAtoms", "kwargs": {"indices": [36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53]}}]vasp{}hTh5H DAs?(Bve?H2wZV_]Uޏ/H?מYB?(BvuH2wZޏ/XמYB?V_]U?ޏ/H?מYB?I`K|%R?dTkaV?DAs(Bve?H2wZK|%bdTkaV?I`?K|%R?dTkaV?=e5]Ot}kHcC7?t ;Gy*vk I?4 ;?y*صݒ<&:,BE?y*Um77Mo?vk I4 ;?y*صݒ{8?h㈵>-l`?unڌPB4?{(h㈵>ltOq\NjPunڌP8fٓL?D-ͭ@?8j3S?m_`s MR?}:3PY?D-ͭP8j3S?}"Ob}:3PY?m_?`s MR?}:3PY?_vON¾DA?_vOF?8fٓLD-ͭ@?8j3S?¾DQ_vOF?_vON?¾DA?_vOF?:vPz6>wJ]2Q?]kSUh:fo!q?]kSUh <^uR_v]kSUhƅ!Y:fo?!q?]kSUh <^?uR_v]kSUhz6>w?J]2Q?]kSUh&p붿zpwnp?={.Sc?O=඲? "RsO=඲?5&?-C6πz3j?zpwnp={.Sc?O=඲?rQ-"?Z H?(?Z H(?-C6*?πz3j?rQ-"Z H?(?5&-C6πz3j? F?W}?W}?3T?򚼯H{"str_E": -196.51962, "slab_E": -192.84492, "atom_E": -1.1170954, "ads_E": -2.5576046000000012, "distance": 0.923741, "Dipole_val": 0.0180501, "plane_index": 111, "ads_site": "3h"}{}7?F ?}W@ #@lA #M 39ae61a8add7d7967bd0960a9d1f9cba   systems   6   ads_site# plane_index ! Dipole_val  distance ads_E  atom_E  slab_E str_E  ads_site3h rr# plane_indexo! Dipole_val?{  distance?II- ads_Euf atom_Eߟm1O slab_Eh  str_EhK  version9 #M 39ae61a8add7d7967bd0960a9d1f9cba   @7~֋  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