Dear QE users and developers,
I can not continue with my calculations of geometry optimization using
lfcpopt (QE develop version), because the calculation always exited after
the first step of the optimization. Prior to the second optimization step, It
simply stopped after the following messag
Hi, Minoru
What I saw in your email is the garbled codes. Could you please reply again to
my email box: jibia...@foxmail.com
Let me repeat the previous email
I am performing calculations of geometry optimization using lfcpopt (QE develop
version), but the calculation always exited after th
From: users on behalf of Jibiao Li
Reply-To: Quantum ESPRESSO users Forum
Date: Thursday, July 9, 2020 19:58
To: users
Subject: [QE-users] Geometry optimization using lfcpopt exited without any
error message
Dear QE users and developers,
I am
Dear QE users and developers,
I am performing calculations of geometry optimization using lfcpopt (QE develop
version), but the calculation always exited after the first step of the
optimization. Prior to the second optimization step, It simply stopped after
the following message:
Writing
Dear QE users and developers,
I am performing calculations of geometry optimization using lfcpopt (QE develop
version), but the calculation always exited after the first step of the
optimization. Prior to the second optimization step, It simply stopped after
the following message:
Writing