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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values ( key TEXT, value TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys ( key TEXT, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species ( Z INTEGER, n INTEGER, id INTEGER, FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)etablesystemssystemsCREATE TABLE systems ( id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name unique_id TEXT UNIQUE, ctime REAL, mtime REAL, username TEXT, numbers BLOB, -- stuff that defines an Atoms object positions BLOB, cell BLOB, pbc INTEGER, initial_magmoms BLOB, initial_charges BLOB, masses BLOB, tags BLOB, momenta BLOB, constraints TEXT, -- constraints and calculator calculator TEXT, calculator_parameters TEXT, energy REAL, -- calculated properties free_energy REAL, forces BLOB, stress BLOB, dipole BLOB, magmoms BLOB, magmom REAL, charges BLOB, key_value_pairs TEXT, -- key-value pairs and data as json data BLOB, natoms INTEGER, -- stuff for making queries faster fmax REAL, smax REAL, volume REAL, mass REAL, charge REAL)-Aindexsqlite_autoindex_systems_1systems !(MT<{&@oꐛ @=yX()@a&@5l/@#G@a&@sw@ @SW>&@5l/@=yX()@a&@@@g$@}͍@\*@ͪf$@}͍@-xW$@ͪf$@Q|@@Dj$@Q|@DԷ)@dh$@Q|@׆q$@dh$@rtO @@g$@<O @\*@ͪf$@<O @-xW$@ͪf$@cՐ?ղH@U 70!@cՐ? @ypw.!@cՐ?')@U 70!@G @*@M O/!@#bJ @ @>W[/!@G @!JN?M O/!@W`V@*@M O/!@bհ@ @>W[/!@W`V@!JN?M O/!@o_@@l@%C@)\(@8ܘ@%C@<;k$@8ܘ@Q|@@:@Q|@a)@I@Q|@ףp= $@I@!qO @@l@խN @)\(@8ܘ@խN @<;k$@8ܘ@cՐ?,@!lV@cՐ? @x#@cՐ?F_()@!lV@n @@w;S@r.U @ @`@n @מY?w;S@'>@@w;S@JR@ @`@'>@מY?w;S@q@@@Mb@%C@cbqm(@ףp= @%C@9d$@ףp= @Q|@@>'I@Q|@U+~)@GZ*oG@Q|@@j'$@GZ*oG@A 3mO @@Mb@խN @cbqm(@ףp= @խN @9d$@ףp= @cՐ?@ x#@cՐ? @ x#@cՐ? x#@' @@ x#@' @ @ x#@' @ x#@rCQ@@ x#@rCQ@ @ x#@rCQ@ x#@ Kur|A X?~p>ur1g +jS$DǺVz`$DǺV?z`_xZi{\&K?I2v_xZi?{\&K?xĬWR\U]Q=ԶaD?/K;5k?Ap-N?xĬWR\U]Q?=ԶaD?xĬW?R\U]Q=ԶaD?/K;5kAp-N?xĬW?R\U]Q?=ԶaD?C-r?8j3s .V`Z!>@`?7ܘn .V`Z!>@`7ܘnqR8sS%RWhN?tS%RW?hN?tC-r8j3s .V`Z?!>@`?7ܘn .V`Z?!>@`7ܘnŏ1w-!?JCBYS=Mŏ1w-!??JCBYyTE?_vON !p$P࿫ZQf#?e5]Ot]yTE?_vON? !p$PyTE_vON !p$P࿫ZQf#e5]Ot]yTE_vON? !p$PN ^5? ګ?)q8?F̱??tA}˜?)q8?F̱?tA}˜?i󊧞?@fg;?E?@fg;E?N ^5 ګ?)q8F̱??tA}˜?)q8F̱?tA}˜?vrу?y?@}?≿-a?CRe'{"str_E": -218.52999, "slab_E": -218.52697, "atom_E": 0.0017485894, "ads_E": -0.004768589399992251, "distance": 3.25865, "Dipole_val": -0.0207361, "plane_index": 110, "ads_site": "3b"}{}I?rv?yԙ@Y@˴;D<