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symmetries.py: Forgotten class renames from qpms_c.pyx 

Former-commit-id: c5d64780f618ce0119597da5fb00182727e70732
This commit is contained in:
Marek Nečada 2019-03-02 18:22:29 +00:00
parent 776f07eb06
commit f976a80894
1 changed files with 14 additions and 14 deletions
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28
qpms/symmetries.py
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@ -55,7 +55,7 @@ class SVWFPointGroupInfo: # only for point groups, coz in svwf_rep() I use I_tyt
self.rep3d_gens = rep3d_gens self.rep3d_gens = rep3d_gens
self.rep3d = None if rep3d_gens is None else generate_grouprep( self.rep3d = None if rep3d_gens is None else generate_grouprep(
self.permgroup, self.permgroup,
qpms.irot3(), qpms.IRot3(),
permgroupgens, rep3d_gens, permgroupgens, rep3d_gens,
immultop = None, imcmp = (lambda x, y: x.isclose(y)) immultop = None, imcmp = (lambda x, y: x.isclose(y))
) )
@ -481,8 +481,8 @@ point_group_info = { # representation info of some useful point groups
lambda lMax : (qpms.xflip_tyty(lMax), qpms.yflip_tyty(lMax)), lambda lMax : (qpms.xflip_tyty(lMax), qpms.yflip_tyty(lMax)),
# quaternion rep generators # quaternion rep generators
rep3d_gens = ( rep3d_gens = (
qpms.irot3.xflip(), qpms.IRot3.xflip(),
qpms.irot3.yflip(), qpms.IRot3.yflip(),
) )
), ),
@ -510,9 +510,9 @@ point_group_info = { # representation info of some useful point groups
lambda lMax : (qpms.xflip_tyty(lMax), qpms.yflip_tyty(lMax), qpms.zflip_tyty(lMax)), lambda lMax : (qpms.xflip_tyty(lMax), qpms.yflip_tyty(lMax), qpms.zflip_tyty(lMax)),
# quaternion rep generators # quaternion rep generators
rep3d_gens = ( rep3d_gens = (
qpms.irot3.xflip(), qpms.IRot3.xflip(),
qpms.irot3.yflip(), qpms.IRot3.yflip(),
qpms.irot3.zflip(), qpms.IRot3.zflip(),
) )
), ),
'C4v' : SVWFPointGroupInfo('C4v', 'C4v' : SVWFPointGroupInfo('C4v',
@ -533,8 +533,8 @@ point_group_info = { # representation info of some useful point groups
lambda lMax : (qpms.zrotN_tyty(4, lMax), qpms.xflip_tyty(lMax)), lambda lMax : (qpms.zrotN_tyty(4, lMax), qpms.xflip_tyty(lMax)),
# quaternion rep generators # quaternion rep generators
rep3d_gens = ( rep3d_gens = (
qpms.irot3.zrotN(4), qpms.IRot3.zrotN(4),
qpms.irot3.xflip(), qpms.IRot3.xflip(),
) )
), ),
'D4h' : SVWFPointGroupInfo('D4h', 'D4h' : SVWFPointGroupInfo('D4h',
@ -560,9 +560,9 @@ point_group_info = { # representation info of some useful point groups
lambda lMax : (qpms.zrotN_tyty(4, lMax), qpms.xflip_tyty(lMax), qpms.zflip_tyty(lMax)), lambda lMax : (qpms.zrotN_tyty(4, lMax), qpms.xflip_tyty(lMax), qpms.zflip_tyty(lMax)),
# quaternion rep generators # quaternion rep generators
rep3d_gens = ( rep3d_gens = (
qpms.irot3.zrotN(4), qpms.IRot3.zrotN(4),
qpms.irot3.xflip(), qpms.IRot3.xflip(),
qpms.irot3.zflip(), qpms.IRot3.zflip(),
) )
), ),
'D3h' : SVWFPointGroupInfo('D3h', 'D3h' : SVWFPointGroupInfo('D3h',
@ -585,9 +585,9 @@ point_group_info = { # representation info of some useful point groups
lambda lMax, vflip: (qpms.zrotN_tyty(3, lMax), qpms.yflip_tyty(lMax) if vflip == 'y' else qpms.xflip_tyty(lMax), qpms.zflip_tyty(lMax)), lambda lMax, vflip: (qpms.zrotN_tyty(3, lMax), qpms.yflip_tyty(lMax) if vflip == 'y' else qpms.xflip_tyty(lMax), qpms.zflip_tyty(lMax)),
# quaternion rep generators # quaternion rep generators
rep3d_gens = ( rep3d_gens = (
qpms.irot3.zrotN(3), qpms.IRot3.zrotN(3),
qpms.irot3.xflip(), # if vflip == 'y' else qpms.irot3.xflip(), # FIXME enable to choose qpms.IRot3.xflip(), # if vflip == 'y' else qpms.IRot3.xflip(), # FIXME enable to choose
qpms.irot3.zflip(), qpms.IRot3.zflip(),
) )
), ),
} }