Regarding 2), I had forgotten that we had a fix for that [
https://www.mail-archive.com/[email protected]/msg16030.html
].
Change csh to tcsh by hand in the first line of siteconfig_lapw, or you
can make the same change with the following patch.
I tested the following WIEN2k 18.2 patch and siteconfig_lapw in Ubuntu
14.04 works for me again:
username@computername:~/Desktop$ cd $WIENROOT
username@computername:~/WIEN2k$ ./siteconfig
Word too long.
username@computername:~/WIEN2k$ wget
https://raw.githubusercontent.com/gsabo/WIEN2k-Patches/master/18.2/siteconfig_lapw.patch
...
username@computername:~/WIEN2k$ patch -b siteconfig_lapw
siteconfig_lapw.patch
patching file siteconfig_lapw
username@computername:~/WIEN2k$ ./siteconfig
***********************************************************************
* WIEN 2k *
* site configuration *
***********************************************************************
This is the first time that you install WIEN2k on this computer. Please
follow the subsequent steps to set up WIEN2k.
You seem to have installed the ifort compiler at:
/opt/intel/composer_xe_2013_sp1.1.106/bin/ia32/ifort
Please remember VERSION and PATH for later reference
Your MKLROOT variable is:
/opt/intel/composer_xe_2013_sp1.1.106/mkl
I could not find your MKL_TARGET_ARCH. You will have to specify it later.
Press RETURN to continue
On 8/16/2018 10:02 PM, Gavin Abo wrote:
It looks like you might have two different problems:
1) tcsh: bad interpreter: No such file or directory <- This usually
indicates that tcsh is not installed.
- If using Ubuntu, try installing tcsh using: sudo apt install tcsh
- If using a different Linux distribution, use a search engine
(such as Google) to find out how to install it for your system.
2) The "word too large" should be because the number of sed commands
increased for "alias update_makefiles" in siteconfig. Some systems are
not able to handle the alias with the longer string of commands. For
example, it works fine for me when using Ubuntu 18.04. However, the
script fails with the same error using Ubuntu 14.04. It may be that
the string of sed commands in siteconfig_lapw can be broken into two
alias commands to get it working again for all systems. Using Ubuntu
18.04, however, is the solution that I'm using. I'm transitioning to
the newer Linux distributions since BoltzTraP2 needs Python 3.5 or
higher [1] which may not be available to install with the package
manager in older Linux versions.
[1]
https://www.imc.tuwien.ac.at/forschungsbereich_theoretische_chemie/forschungsgruppen/prof_dr_gkh_madsen_theoretical_materials_chemistry/boltztrap2/
On 8/16/2018 5:30 AM, BUSHRA SABIR wrote:
Prof Peter Blaha and Gavin abo,
i am trying to install wien2k latest version 18.2,
while installation i am facing problem.
In command
./siteconfig_lapw
i face error "word too large"
i go through mailing list and find solutions recommended by Gavin abo
to make changes in first line of siteconfig_lapw
bushra@bushra-MS-7A70:~/Wien2k_18.2$ sed -n 1p siteconfig_lapw
#!/bin/csh -fx
bushra@bushra-MS-7A70:~/Wien2k_18.2$ ./siteconfig
unalias rm
set name = ./siteconfig
set bin = .
if ! ( -d . ) set bin = .
cd .
set bin = `pwd`
pwd
alias define_installdate date >$bin/WIEN2k_INSTALLDATE
alias wait echo "";echo " Press RETURN to continue"; set yn = ($<)
Word too long.
bushra@bushra-MS-7A70:~/Wien2k_18.2$ ./siteconfig
bash: ./siteconfig: /bin/tcsh: bad interpreter: No such file or directory
kindly help me to understand this problem
Bushra Sabir
_______________________________________________
Wien mailing list
[email protected]
http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
SEARCH the MAILING-LIST at:
http://www.mail-archive.com/[email protected]/index.html
