[Pw_forum] How to set "electrons" parameters in ph.x ?
xirainbow
nkxirainbow at gmail.com
Mon Apr 15 07:59:54 CEST 2013
Dear all:
In my calculations(QE 5.0), the *"beta"* and *"diagonalization"*
in **.ph.out* of *ph.x* is different from the **.scf.out* file of *pw.x*.
I set
*"mixing_beta = 0.3*
*diagonalization = 'cg' " *
in scf calculation(pw.x). Then, I find the right parameters in *.scf.out
file.
However, in the **.ph.out* file, I find:
*"beta = 0.7000*
*Davidson diagonalization with overlap" *
in *.ph.out file.
How to set the "*mixing_beta *and* diagonalization*" parameters
in *ph.x*?
Thanks in advance:)
--
____________________________________
Hui Wang
School of physics, Fudan University, Shanghai, China
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