Hi,
Thank you very much for BURAI, it is a fantastic tool much better that pwGUI.
I have several issue that want to describe:
1- Is it possible for you to compile QE with intel-fortran to enhance its performance and speed?
2- In the current version(6.1), when I try to manually execute pw.x (and I have already included all necessary dll files), the number of threads is always set to 8 and so,
mpiexec.exe -np 1 pw.x -in input_file
will correspond to a parallel simulation with 8 cores (or threads) and there is no way to decrease "core/thread number".
3- For evaluation of the current compiled version, I run set of input files to calculate the stress-strain relation of Fe and compared my results with its corresponding unix version. The results are much different, especially in calculated stress - tstress=.TRUE. (I thought maybe there is a bug in compiled windows pw.x).
4- This is a personal request: Can you please compile version 5.4 for windows 10 64-bit and email it for me? I am not familiar with compilation of linux-based programs on windows and this will really help me at the moment.
Thank you very much.
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