[QE-users] Preconditioner

Andrew Xu andrewaccount at gmail.com
Tue Feb 23 22:49:28 CET 2021


Hi users,

The preconditioner in LR_modules/h_prec.f90 is given in terms of the
quantity eprec, which is 1.35 times the expectation value of the kinetic
energy. Where does the 1.35 come from?

I saw that this question was asked a number of years ago in the developers'
mailing list (
https://lists.quantum-espresso.org/pipermail/developers/2013-May/000505.html),
but there was no answer there.

Best,
Andrew
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20210223/d9fe9aa4/attachment.html>


More information about the users mailing list