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))$++tabletext_key_valuestext_key_valuesCREATE TABLE text_key_values (
key TEXT,
value TEXT,
id INTEGER,
FOREIGN KEY (id) REFERENCES systems(id))sItablekeyskeysCREATE TABLE keys (
key TEXT,
id INTEGER,
FOREIGN KEY (id) REFERENCES systems(id)) otablespeciesspeciesCREATE TABLE species (
Z INTEGER,
n INTEGER,
id INTEGER,
FOREIGN KEY (id) REFERENCES systems(id))P++Ytablesqlite_sequencesqlite_sequenceCREATE TABLE sqlite_sequence(name,seq)etablesystemssystemsCREATE TABLE systems (
id INTEGER PRIMARY KEY AUTOINCREMENT, -- ID's, timestamps and user name
unique_id TEXT UNIQUE,
ctime REAL,
mtime REAL,
username TEXT,
numbers BLOB, -- stuff that defines an Atoms object
positions BLOB,
cell BLOB,
pbc INTEGER,
initial_magmoms BLOB,
initial_charges BLOB,
masses BLOB,
tags BLOB,
momenta BLOB,
constraints TEXT, -- constraints and calculator
calculator TEXT,
calculator_parameters TEXT,
energy REAL, -- calculated properties
free_energy REAL,
forces BLOB,
stress BLOB,
dipole BLOB,
magmoms BLOB,
magmom REAL,
charges BLOB,
key_value_pairs TEXT, -- key-value pairs and data as json
data BLOB,
natoms INTEGER, -- stuff for making queries faster
fmax REAL,
smax REAL,
volume REAL,
mass REAL,
charge REAL)-A indexsqlite_autoindex_systems_1systems
2& M ,L Ll - 8860f27278154cf87a3f048df6d1ce52@4ۜl@9 :"@TtA@ m #@sF6,@ݰmQ @o%;'@ o +@ ܝ(@K7A @;SƎ@Tt!@˹W"@/$!@('r%@u@ѮBO:'@[[)@J'@#JvL @MJA @|г'@(r%@\='oL%@i*@\Z
{'@QH*@
GĔ"@+H%@HPsw(@x@t @u0#@ x]!@d**@S"^ @C48!@0| @E|' @ &N @ZӼ"@ }"$@~p&@89@P@v'@,E|&@|-)@d
"@B"@R,@"A(@8)@z,C +%@CԷ|"@p_ @_(@v# @]o@<;kW%@"~
&@ ^/؍"@E>*@Y(@Z_$)@J{/L @/Q5 @'UHI @HIO7 @rK$@=$@!@d@t>*@ͯ &@5Fj2%@.9(av&@Tގp#@ Mܯ@')#@
GĔ@B 3mJ%@+j0
)@5A} r%@x@ٴ'@e6Ȕ$@p:@@ .9'@
1Z(@"A @r])@|гY)@mO&@Yo @##@XV @Nw(
@Kq%@B`" @CsFZ @5Y *@ʡE%@N@"@9s*@=$@}"@ꭁ(@++M:'@Lۿ @5$'@+0du(@HIO#@<,Ԛ @ <$@\8L@+"@ x])@}"O!@HhI @@x=)@BF!@fN%@3yS'@;T. @[%X ά"@(@ t// @m/%@Ӽ Y(@8ܘ @{ @ͯ +@㥛 "@ "@ 4@ 4@ 4@vasp{}AG"rH}]. Lt߇(_p10&D?gF?Nk?=NY4GV~a U9CqǛv@5_%_eYJc?$p?. X?Cr1{vQ?= C?V횐8?GJ켍͎?3ۃ`zю[?DJy?ZQfs?Nz1SA ]\BT8 nV^
z!>@@?2;pY GY4 rH?DXP8? $D"?HPXDXP8 $D"HPX?pY G?Y4 r?H^
z?!>@@2;?A ]\?BT?8 nV?DJyZQfsNz1S?켍͎3ۃ`?zю[. XCr?1{vQ= CV횐8GJ?@5_%_?eYJc$p4GV~a? U?9CqǛv?H}]?. Lt?߇(_p?10&DgF?Nk=NY?h.Kr?JUg$B#x%"1s?Tb.A~bUm?[:r;y9{?$xC%?S H9topQeX?i:}C4i'/2Fr?K^b,?Oy?]/M1?BO}?3ۃp?9:Zb?Sr/0+d 8Krb?Wn3pkb#-#F?:y 5b(ȯo | +,o?N ^Up\M
4o+MFa|?30&f?mnLOx?Ց#m yJ4A?N ^Y9
Q?{?
Om9?J4q?,G@}e`[0xno?~jtc?wspaS?AΡ U?bFx{@? b0ke?Xo
zYrLVh r?o
+-s}?Tq?\nK䂃?|,G@n?Ps?Con'@jSZF=~?$ptueV?RagܶqnC?/"e?]/MQ#KXu @t_bUZ ~Bd6pdGJ Ҩ6?d3xW>?:8؛X?a2U0*#I4*I2f?ڨNn? {z?j=&Rz?ZPۆnIu:8؛Xa2U0*#?I4*?I2fڨNn {z#KXu? @t_b?UZ ~?j=&RzZPۆ?nIu? Ҩ6d3x?W>Bd?6pd?GJ?'@jS?ZF=~$ptu?qnC/"e]/MQ?eVRa?gܶ? b0k?eXo
z?|,G@nPsCon?0xno~jtcws?-s}Tq\nK䂃paSAΡ UbFx{@YrLV?h ro
+?N ^Y?9
Q?{
Om9J4q,G@}?e`[?Ց#m? y?J4A3p?kb?#-#F+MFa|30&fmnLOx +,oN ^U?p\M
4o?Sr/0+d? 8KrbWn?:y 5b?(ȯo? | ?BO}3ۃp9:Zb[:r?;y9{$xC%K^b,Oy]/M1i:}?C4i?'/2FrS H9t?o?pQeXh.KrJ?Ug$B#x?%"1sTb.A?~bUmJ8 ?Ni?!?y(+?>.LZ>Vk>{"perms_num": 6} {}T?S?n ?!Ӳ @@F`A