set CONDA_DEFAULT_ENV=base
set CONDA_EXE=C:\Anaconda3\Scripts\conda.exe
set CONDA_PREFIX=C:\Anaconda3
set CONDA_PROMPT_MODIFIER=(base)
set CONDA_PYTHON_EXE=C:\Anaconda3\python.exe
set CONDA_SHLVL=1
set Path=C:\Anaconda3;C:\Anaconda3\Library\mingw-w64\bin;C:\Anaconda3\Library\usr\bin;C:\Anaconda3\Library\bin;C:\Anaconda3\Scripts;C:\Anaconda3\bin;C:\Anaconda3\condabin;%Path%
set PYTHONPATH=c:\Programs\python\lib:%PYTHONPATH%

rem iPoint: Point of chemical potential: 0, 1, ...
set iPoint=0

python ..\vasp_defect.py EF min input.xlsx . %iPoint% 300 -0.2 1.954 101
python ..\vasp_defect.py EF all input.xlsx . %iPoint% 300 -0.2 1.954 101
python ..\vasp_defect.py T input.xlsx . %iPoint% 300 600 51
