Re: [Wien] Error while running the command ./siteconfig_lapw during installation of WIEN2k code

2018-01-19 Thread Gavin Abo
In the terminal, type the command [1]: locale Is LC_NUMERIC set to en_US.UTF-8?  If Linux is installed with a language other than English, the WIEN2k scripts like siteconfig_lapw sometimes don't run properly. The "if: Expression Syntax" can happen if one side of the operator in an if

Re: [Wien] wien2k 17.1 installation error on compiling lapw0

2018-01-19 Thread Gavin Abo
This may be because libxc was compiled with a different compiler (like gfortran) instead of with ifort, refer to the post at: https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg15222.html Note: Instead of libxc 3.0.0, if you prefer to use the newer version of libxc (4.0.3) [

[Wien] Error while running the command ./siteconfig_lapw during installation of WIEN2k code

2018-01-19 Thread Sourav Dey
Dear Prof. Blaha and Prof. Schwarz, I have downloaded the WIEN2k 17.1 code and am trying to install it in a Ununtu 16.04 LTS version desktop. The hardware configuration is : intel i5 quadcore processor, 1TB hardisk and 8 GB RAM. I have installed gfortran compiler and csh in Ubuntu. I am getting