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vasp|
linux|
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research|
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QE|
writing|
USPEX|
materials studio|
siesta|
dftb+|
gaussian|
yambo|
- dftb+
- comatsci.tar.gz mkdir ~/bin/comatsci export PYTHONPATH=$PYTHONPATH:/home/zhou/bin/comatsci//lib/python2.7/site-packages/ python setup.py build python setup install --prefix=/home/zhou/bin/comatsci togen poscar poscar.gen
