[Wien] error in k-point parallel execution
Torsten Andersen
thor at physik.uni-kl.de
Thu Jul 29 09:20:38 CEST 2004
Mahmoud Payami wrote:
> Dear Dr. Andersen,
>
> For your information, I have run the TiC example on each node using w2web
> separately, and no problem.
>
>
>
>>So the other lapw1's doesn't even start. This is useful information,
>>although I am not immediately sure of the consequences. I will be
>>guessing, though...
>>
>>What I mean is: When you log in on condmat2, do you have the same home
>>directory as on localhost? You can test this with "touch file_of_zero"
>>on localhost, then see if it is also present on condmat2.
>
>
> I executed the command "touch file_of_zero" on both "localhost" and
> "condmat2" and no output resulted but the shell prompt.
Then you spoiled it! You should have done that on one machine and only
looked for it on the other one!!!! Now you should remove it on localhost
and see if it is still on condmat2... or "touch another_file_of_zero" on
localhost only and check if it exist on condmat2.
You can also check if the timestamp is the same on the two files you
created before.
I think I will conclude that you do not have shared directories. I
believe you should read the Linux NFS-HOWTO, since I can't set it up for
you remotely.
>
>
>>When you set up Wien2k, it modifies your .cshrc (csh configuration) and
>>sets a SCRATCH environment variable. Does the directory in this variable
>>exist on all machines?
>
>
> I use "bash" and the content of ".bashrc" in both computers are the same:
>
> ++++++++++++++
> # .bashrc
>
> # User specific aliases and functions
>
> # Source global definitions
> if [ -f /etc/bashrc ]; then
> . /etc/bashrc
> fi
> # added by WIEN2k: BEGIN
> # --------------------------------------------------------
> alias lsi="ls -aslp *.in*"
> alias lso="ls -aslp *.ou*"
> alias lsd="ls -aslp *.def"
> alias lsc="ls -aslp *.cl*"
> alias lss="ls -aslp *.sc*"
> alias lse="ls -aslp *.error"
> alias pslapw="ps -ef |grep "lapw""
> export EDITOR="emacs"
> export SCRATCH=./
> export WIENROOT=/home/wien2k/.WIEN_ROOT
> export PDFREADER=acroread
>
> export PATH=$PATH:$WIENROOT:.
> # --------------------------------------------------------
> # added by WIEN2k: END
> ++++++++++++++++++++++++++++
>
>
>>What do you get from "echo $SCRATCH" on localhost and condmat2?
>
>
> I get "./" from both pc's.
>
>
>>What do you get from "echo $path" on localhost and condmat2?
>
>
> I get nothing using "echo $path" but usin "env" I get:
>
> ------------------
> LESSKEY=/etc/.less
> LC_PAPER=en_US
> KDE_MULTIHEAD=false
> SSH_AGENT_PID=2757
> LC_ADDRESS=en_US
> LC_MONETARY=en_US
> HOSTNAME=condmat1.ctpm.aeoi.org
> TERM=xterm
> SHELL=/bin/bash
> HISTSIZE=1000
> XDM_MANAGED=/var/run/xdmctl/xdmctl-:0,maysd,mayfn,sched,rsvd
> GTK2_RC_FILES=/usr/share/themes/Galaxy/gtk-2.0/gtkrc:/etc/gtk-2.0/gtkrc:/hom
> e/mahmoud/.gtkrc-2.0:/home/mahmoud/.kde/share/config/gtkrc
> TMPDIR=/home/mahmoud/tmp
> GTK_RC_FILES=/usr/share/themes/Galaxy/gtk/gtkrc:/etc/gtk/gtkrc:/home/mahmoud
> /.gtkrc:/home/mahmoud/.kde/share/config/gtkrc
> GS_LIB=/home/mahmoud/.fonts
> WINDOWID=33554437
> PDFREADER=acroread
> LC_NUMERIC=en_US
> QTDIR=/usr/lib/qt3/
> KDE_FULL_SESSION=true
> USER=mahmoud
> XCURSOR_SIZE=
> LS_COLORS=no=00:fi=00:di=01;34:ln=01;36:pi=40;33:so=01;35:bd=40;33;01:cd=40;
> 33;01:or=01;05;37;41:mi=01;05;37;41:ex=01;32:*.cmd=01;32:*.exe=01;32:*.com=0
> 1;32:*.btm=01;32:*.bat=01;32:*.sh=01;32:*.csh=01;32:*.tar=01;31:*.tgz=01;31:
> *.arj=01;31:*.taz=01;31:*.lzh=01;31:*.zip=01;31:*.z=01;31:*.Z=01;31:*.gz=01;
> 31:*.bz2=01;31:*.bz=01;31:*.tz=01;31:*.rpm=01;31:*.cpio=01;31:*.jpg=01;35:*.
> gif=01;35:*.bmp=01;35:*.xbm=01;35:*.xpm=01;35:*.png=01;35:*.tif=01;35:
> LC_TELEPHONE=en_US
> SSH_AUTH_SOCK=/tmp/ssh-nWKi2681/agent.2681
> SESSION_MANAGER=local/condmat1.ctpm.aeoi.org:/tmp/.ICE-unix/2804
> GNOME_DISABLE_CRASH_DIALOG=1
> KONSOLE_DCOP=DCOPRef(konsole-4448,konsole)
> NLSPATH=/usr/share/locale/%l/%N
> MAIL=/var/spool/mail/mahmoud
> DESKTOP_SESSION=default
> PATH=/usr/bin:/bin:/usr/bin:/usr/local/bin:/usr/X11R6/bin/:/usr/games:/home/
> wien2k/.WIEN_ROOT:.:/home/mahmoud/bin:/usr/lib/ssh:/home/wien2k/.WIEN_ROOT:.
> LC_MESSAGES=en_US
> SECURE_LEVEL=2
> LC_IDENTIFICATION=en_US
> LC_COLLATE=en_US
> KONSOLE_DCOP_SESSION=DCOPRef(konsole-4448,session-1)
> INPUTRC=/etc/inputrc
> PWD=/home/mahmoud
> XMODIFIERS=@im=none
> EDITOR=emacs
> LANG=en_US
> HELP_BROWSER=kfmclient openProfile webbrowsing
> LC_MEASUREMENT=en_US
> SSH_ASKPASS=/usr/lib/ssh/gnome-ssh-askpass
> HISTCONTROL=ignoredups
> SHLVL=2
> HOME=/home/mahmoud
> LANGUAGE=en_US:en
> XCURSOR_THEME=default
> GCONF_TMPDIR=/tmp
> TMP=/home/mahmoud/tmp
> LESS=-MM
> LOGNAME=mahmoud
> LC_CTYPE=en_US
> LESSOPEN=|/usr/bin/lesspipe.sh %s
> BROWSER=kfmclient openProfile webbrowsing
> DESKTOP=kde
> WIENROOT=/home/wien2k/.WIEN_ROOT
> DISPLAY=:0.0
> LC_TIME=en_US
> SCRATCH=./
> G_BROKEN_FILENAMES=1
> COLORTERM=
> XAUTHORITY=/home/mahmoud/.Xauthority
> LC_NAME=en_US
> _=/usr/bin/env
> OLDPWD=/home/mahmoud
> --------------------------------
>
> which is the same as in condmat2.
>
>
>>When you log in on condmat2, can you execute lapw1 manually? Try, in a
>>shell: "which lapw1", and if it gives you a response, try "lapw1". What
>>is the result?
>
>
> I tried "which lapw1" on both PC's and obtained:
> "/home/wien2k/.WIEN_ROOT/lapw1".
>
> I tried "run lapw1" on both PC's in the directory TiC which I had already
> worked with, and obtained:
> ------------
> ERROR: option lapw1 does not exist !
>
> LAPW0 END
> LAPW1 END
> LAPW2 END
> CORE END
> MIXER END
>
> in cycle 2 ETEST:0 CTEST:0
>
> LAPW0 END
> ...
> ----------------------------
>
> Looking forward to hearing from you.
>
> Kind regards,
> Mahmoud Payami
>
>
>
>
>
>><snip> Your .machines is ok, I think.
>>
>>Best regards,
>>Torsten Andersen.
>>
>>--
>>Dr. Torsten Andersen TA-web: http://deep.at/myspace/
>>AG Hübner, Department of Physics, Kaiserslautern University
>>http://cmt.physik.uni-kl.de http://www.physik.uni-kl.de/
>>
>>_______________________________________________
>>Wien mailing list
>>Wien at zeus.theochem.tuwien.ac.at
>>http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
>>
>>
>
>
>
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>
--
Dr. Torsten Andersen TA-web: http://deep.at/myspace/
AG Hübner, Department of Physics, Kaiserslautern University
http://cmt.physik.uni-kl.de http://www.physik.uni-kl.de/
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