QPMS
/
qpms
1
0
Fork 0
Code Issues Pull Requests Projects Releases Wiki Activity

Some more description of intent in symmetries.h 

Former-commit-id: c5d64a7a203e5e50d9faadf0a085e5b895cf7d78
This commit is contained in:
Marek Nečada 2018-12-25 22:43:57 +02:00
parent cee14a69e3
commit 7fb84d1d02
1 changed files with 10 additions and 0 deletions
Show Stats Download Patch File Download Diff File Expand all files Collapse all files

10
qpms/symmetries.h
View File

@ -6,8 +6,18 @@
* operating on translation operators and T-matrices * operating on translation operators and T-matrices
* as in tmatrices.py. * as in tmatrices.py.
* *
* At least I want:
* - Wigner D matrices
* - Basic mirror operations for T-matrices
* - Inversion operation for the translation matrices
*
* Maybe (much later) also point and space group irrep * Maybe (much later) also point and space group irrep
* functionality as in symmetries.py. * functionality as in symmetries.py.
* However, I think that the group structures can be simply
* hard-coded/generated by a python script, then there is
* no need to check the group consistency etc. at runtime.
*
*
*/ */
#endif // SYMMETRIES_H #endif // SYMMETRIES_H