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Bingbing Suo is own page. | = Bingbing Suo is own page. = |
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1 Add Wiki theme moon-mandrin. Look at the link [[https://bitbucket.org/thesheep/moin-mandarin]] | 1 Add Wiki theme moin-mandarin. Look at the link [[https://bitbucket.org/thesheep/moin-mandarin]] 2 Try to edit a bdftheme from modernized theme. 1. Make a copy of the 'modern' theme in the static files directory and call it 'bdftheme' 1. Copy the script of this theme MoinMoin/theme/modern.py' to data/plugins/theme/bdftheme.py 1. Edit the file 'bdftheme.py' and change at least the variable name = "modernized" to {name ="bdftheme" Filename for all kind of local orbitals in BDF: {{{ 1. localorb - local orbital generated by BDF module localmo. Boys and trust region methods are used in orbital localization. 2. blmo - Boys. 3. tlmo - Trust region. 4. flmoorb - fragment local orbital generated by bottom-up method. 5. pflmo - norm-orthogonal pFLMO. }}} == BDF git version control user's guide == Start from a clean BDF copy bdfpkg {{{ cd bdfpkg git init git add git config --global user.name "your name" git config --global user.email "youremail@domain" git commit -m "Creat BDF package store" }}} == get a bdf work copy == {{{ Obtain a bdf work copy git clone youname@10.105.153.100:/export/gitroot/bdf-pkg Create your own branch git branch myown Switch to your new branch git checkout myown }}} |
Bingbing Suo is own page.
Wiki logs
1 Add Wiki theme moin-mandarin. Look at the link https://bitbucket.org/thesheep/moin-mandarin
2 Try to edit a bdftheme from modernized theme.
- Make a copy of the 'modern' theme in the static files directory and call it 'bdftheme'
- Copy the script of this theme MoinMoin/theme/modern.py' to data/plugins/theme/bdftheme.py
- Edit the file 'bdftheme.py' and change at least the variable name = "modernized" to {name ="bdftheme"
Filename for all kind of local orbitals in BDF:
1. localorb - local orbital generated by BDF module localmo. Boys and trust region methods are used in orbital localization. 2. blmo - Boys. 3. tlmo - Trust region. 4. flmoorb - fragment local orbital generated by bottom-up method. 5. pflmo - norm-orthogonal pFLMO.
BDF git version control user's guide
Start from a clean BDF copy bdfpkg
cd bdfpkg git init git add git config --global user.name "your name" git config --global user.email "youremail@domain" git commit -m "Creat BDF package store"
get a bdf work copy
Obtain a bdf work copy git clone youname@10.105.153.100:/export/gitroot/bdf-pkg Create your own branch git branch myown Switch to your new branch git checkout myown