[Wien] Error in Nearest neighbor program when running TiC example

it does you >> know that it is the web interface. If it fails, let us know how. >> >> >> On Tue, Jul 15, 2008 at 4:22 PM, John Bevington wrote: >>> >>> I tried changing /bin/csh to /bin/tcsh in all *_lapw scripts but that did >>> not correct the error. Should I try compil

[Wien] Error in Nearest neighbor program when running TiC example

5 Jul 2008 14:07:47 +0200 >> From: pblaha at theochem.tuwien.ac.at >> To: wien at zeus.theochem.tuwien.ac.at >> Subject: Re: [Wien] Error in Nearest neighbor program when running TiC >> example >> >> Only a vague idea: >> Maybe your csh shell is not ok. >>

[Wien] Error in Nearest neighbor program when running TiC example

> From: L-marks at northwestern.edu > To: wien at zeus.theochem.tuwien.ac.at > Subject: Re: [Wien] Error in Nearest neighbor program when running TiC > example > > Recompiling with a different version of ifort/mkl almost certainly > (99.999%) will have no effect. What the message

[Wien] Error in Nearest neighbor program when running TiC example

t > To: wien at zeus.theochem.tuwien.ac.at > Subject: Re: [Wien] Error in Nearest neighbor program when running TiC > example > > Only a vague idea: > Maybe your csh shell is not ok. > > Please edit in $WIENROOT the file x_lapw and replace /bin/csh by /bin/tcsh

[Wien] Error in Nearest neighbor program when running TiC example

Only a vague idea: Maybe your csh shell is not ok. Please edit in $WIENROOT the file x_lapw and replace /bin/csh by /bin/tcsh If this works, you should maybe do this change in all *_lapw scripts (or install a proper csh, eventually simply copying tcsh over csh). John Bevington schrieb: > After

[Wien] Error in Nearest neighbor program when running TiC example

Dear all I am now also tryed to run TiC example, and got the same error. Then I tryed putting only the TiC.struct file, added to WIEN2k program, in the working directry, and I run StructGen. Then the TiC.struct file changed to strange form... TiC

[Wien] Error in Nearest neighbor program when running TiC example

After compiling wien2k, I tired to run the TiC example as per the Quick Start instructions in the UG. I can generate a structure file using StuctGen and view the TiC structure with XCRYSDEN. However, when I try to run nn (nearest neighbors) under initialize calc I get the following error: Co