I tried changing /bin/csh to /bin/tcsh in all *_lapw scripts but that did not correct the error. Should I try compiling with a different version of ifort and/or mkl?
---------------------------------------- > Date: Tue, 15 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. > > 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 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: >> >> Commandline: x nn >> Program input is: "2 " >> >> argv1: Subscript out of range. >> >> I've searched the mailing list, checked and re-checked the users guide and >> found nothing. Am I missing something simple? Please help... >> >> - Thanks >> >> P.S. My system info: >> >> Dell workstation T7400 (w/dual Xeon quad core processors) >> Fedora 9 >> Intel fortran compiler 10.1.015 >> Intel MKL 10.0.3.020 >> wien2k v8.2 >> _________________________________________________________________ >> Making the world a better place one message at a time. >> http://www.imtalkathon.com/?source=EML_WLH_Talkathon_BetterPlace >> _______________________________________________ >> Wien mailing list >> Wien at zeus.theochem.tuwien.ac.at >> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien > > -- > > P.Blaha > -------------------------------------------------------------------------- > Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna > Phone: +43-1-58801-15671 FAX: +43-1-58801-15698 > Email: blaha at theochem.tuwien.ac.at WWW: > http://info.tuwien.ac.at/theochem/ > -------------------------------------------------------------------------- > _______________________________________________ > Wien mailing list > Wien at zeus.theochem.tuwien.ac.at > http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien _________________________________________________________________ The i?m Talkaton. Can 30-days of conversation change the world? http://www.imtalkathon.com/?source=EML_WLH_Talkathon_ChangeWorld