Search found 2 matches

by lizhou yang
Tue Mar 31, 2026 3:54 pm
Forum: Running the code
Topic: EPW stop when reading “patterns.1.xml” file
Replies: 2
Views: 3499

Re: EPW stop when reading “patterns.1.xml” file

I delete nosym=.true. and my problem solved, it is very helpful!
by lizhou yang
Wed Jun 18, 2025 2:53 am
Forum: General discussion
Topic: Error in routine set_giq (1): problem with minus_q
Replies: 0
Views: 158949

Error in routine set_giq (1): problem with minus_q

Dear Developers, This error occurs in epw1.out, when I follow the instruction exercise2 in https://docs.epw-code.org/_downloads/162412559797a286a30b1e7f8f7bf0f0/Wed.5.Ponce.pdf Here are my inputs scf.in &CONTROL calculation = 'scf' prefix = 'NbOCl2' outdir = './' pseudo_dir = '/public/home/yanglz/QE ...