[Wien] Issue with wien2k + xcrysden

[Gavin Abo]

Did you set XCRYSDEN_TOPDIR and included it in the PATH in .bashrc [ 
https://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg11246.html 
]?

To help set the variables automatically, you can run the xcConfigure.sh 
of XCrySDen (in the scripts folder for version 1.5.60).  However, it 
only creates the XCrySDen block in .bashrc the first time that you run 
it.  So if the location and/or version of XCrySDen on the system 
changes, you have to delete the XCrySDen block so that running 
xcConfigure.sh again will recreate the block.

Or you could also manually create and edit by hand the XCRYSDEN_TOPDIR 
and PATH variables, if you prefer to do it that way (without using 
xcConfigure.sh).

On 2/6/2015 10:12 AM, Murugan Sundareswari wrote:
> Dear All.
>
> Initially, we ran Wien2k without xcrysden. We later wanted to include 
> xcrysden with w2web. After installing xcrysden, we do not get the view 
> structure option.
>
> What did we do?
> 1 Installed xcrysden - xcrysden works pretty well as stand alone.
> 2 Tried killing w2web and restarting w2web - did not help
> 3 Tried restarting the system and used as local system - did not help
> 4 Re ran the siteconfig and Recompiled wien2k - did not help
>
> What versions do we have
>
> Xcrysden 1.5.6
> Wien2K Ver 13
>
> Please advice.
> Regards
>
> Sundareswari