UT theoretical chemistry code forum

Thank you for your answers. I also tried the example CHGCAR from your site and the program again crashed. I compiled it using the Makefile.pgf and I also tried the Makefile.pgf_32. It is than compiled with pgf90 -O3 -fast -c I don´t know the exact version of the portland compiler on our machine, but...

I tried compilinge the src, which seemed to work.
But using this bader file, I get a segmentation fault error when trying to run it on a MgO CHGCAR.

hello, I just downloaded the bader analysis program from: http://theory.cm.utexas.edu/henkelman/research/bader/index.php the bader_lnx.tar file. When I run it for vasp CHGCAR output with "bader CHGCAR" the program does the Edge refining iterations but just seems to stop when no more edge p...