Hi Gavin Thank you,
It helped and I am able to run Boltztrap, however I get factorization error. Even as I attempt with the highest possible K points, same error continues... Could you advice.... On Thu, Jan 22, 2015 at 2:26 PM, Gavin Abo <gs...@crimson.ua.edu> wrote: > It does sound like a problem with the setting of the environment. You > should consult your operating system documentation on how to set the > environment so that it can find the libblas.so.3gf on your system. > Usually, that involves setting an environmental variable in .bashrc or > setting a location in a conf file. Or another way can be to change the > compile settings so that they libraries are compiled into the executable > instead of just linked to them [ http://en.wikipedia.org/wiki/Static_build > ]. > > However, if WIEN2k works, I think BoltzTraP should work too. Have you > adjusted the compile settings in the BoltzTraP Makefile so that they are > the same (or similar) to the ones you have used for WIEN2k? > > It seems like libblas.so.3gf might be from an operating system (OS) > package, which might be a little unusual to link to. As I think usually it > is not linked against on from OS, but from one that comes with ifort or > from complied from a source package like OpenBLAS. > > > On 1/21/2015 10:14 PM, Murugan Sundareswari wrote: > >> Dear Wien2k users, >> >> We are using Wien2k 13.1 version through W2Web feature. We have been >> using Wien without much issues. Now we wanted to implement BoltzTraP code >> (VER V1.2.5) for studying the thermo electric properties. >> >> We have installed BLAS and LAPAK in our Suse based system. When we try >> running the built in test samples given in BoltzTraP we get errors that >> BoltzTraP is not able to find libblas.so.3gf. >> >> We are not sure if we have made some mistakes while setting environment >> for the code. >> >> Could some one help us with the installation sequence and what are the >> prerequisites (that I could have missed) for BoltzTraP please? >> >> Regards >> Parth >> > _______________________________________________ > Wien mailing list > Wien@zeus.theochem.tuwien.ac.at > http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien > SEARCH the MAILING-LIST at: http://www.mail-archive.com/ > wien@zeus.theochem.tuwien.ac.at/index.html >
_______________________________________________ Wien mailing list Wien@zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien SEARCH the MAILING-LIST at: http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html