Search found 2 matches

by shkwon
Thu Aug 24, 2023 1:26 pm
Forum: Bader
Topic: Bader charge analysis of adsorption on surface
Replies: 1
Views: 13802

Bader charge analysis of adsorption on surface

Hello, I did Bader charge analysis on the system, which is oxygen absorbed on the metal carbide (MC) surface. From the manual, I learned the procedure: ZVAL - CHARGE from ACF.dat = Bader charge. And I did the following, but I was wondering that when Calculating Bader charge of adsorption on surface,...
by shkwon
Fri Aug 11, 2023 3:58 am
Forum: Bader
Topic: Bader Installation Problem
Replies: 1
Views: 13865

Bader Installation Problem

Hello, I am new to Bader charge analysis and I am trying to install Bader in Linux. So, I downloaded 'bader.tar.gz' and 'bader_lnx_64.tar.gz'. And then, I unzipped those and typed 'chmod +x bader' and also, 'cd bader', 'cp makefile.lnx_ifort makefile', 'make' in a row. Then, this error code has appe...