Dear administraters or technicians of WIEN2k,Hello. I am an user of WIEN2k v17.1 and now upgraded to 18.2.(The specification of my nodes is 2 CPUs with 56 threads in total (Xeon intel E5-2696 series) and CentOS 17.)(I had no installation problems for ./siteconfig when I compiled all with intel com
What does "ls -al ~/.ssh/config" give you?
That error is reproducible with Ubuntu 18.04.1 LTS:
username@computername:~$ cat ~/.ssh/config
Host *
HostName 127.0.0.1
User username
ForwardX11Trusted yes
GatewayPorts yes
GSSAPIAuthentication yes
username@computername:~$
The energy is a very crude test of convergence and can be misleading. You
should look at the magnetic moments (:MM*), the interstitial charge and
pseudo charge (":CTO ", :CPC) and the orbital moments. They may be walking.
If they are really oscillating (which :ENE won't show), MSEC3 may help.
Don't
Dear wien2k users,
I am running wien 18.2 on Ubuntu 18.04 , installed on a HP station:
64GB, Intel® Xeon(R) Gold 5118 CPU @ 2.30GHz × 48.
The fortran compiler/math library are ifc and intel mkl library. For
parallel execution I have MPI+SCALAPACK, FFTW.
When calculating multilayered struct
A NaN means that something has gone wrong. While this may show up with the
mixer, it probably occurs somewhere else. When I look at your struct file,
the Mg and O atoms at the interface have low BVS, indicating that there
will be a significant contraction along your z axis. You picked RMTs for
the
You have User localhost in your config file ???
localhost should be your hostname, but not a user ???
I'd mv config to config_save (usually one does not need a config file).
Try:
ssh localhost
can you login without a username/password ??
If not, either the hostname is not supported,
Remove the config file.
Your username seems to be: User
You don't want a user localhost
localhost is the hostname, not the username.
Weitergeleitete Nachricht
Betreff: [RE]Re: [Wien] Fail to parallel calculation of lapw1 and lapw2
(testpara1 and testpara2)
Datum: Mo
Please study a bit of Linux !
the ssh command connects to another computer (can also be the same).
The syntax isssh user@hostname; or if you want to use the same
username, it is enough to use ssh hostname
You tried:
ssh User
and it told you:
ssh: Could not resolve hostname user: Name
FYI, when I have followed the instructions for setting up ssh
passwordless login using ssh-kgen given at the link below, it has always
gone well for me:
https://www.tecmint.com/ssh-passwordless-login-using-ssh-keygen-in-5-easy-steps/
First, you might want to check if you have the following fil
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