Search found 2 matches
- Mon Feb 13, 2023 2:04 am
- Forum: Running the code
- Topic: Error in routine set_u_matrix (1): |xaxis| < eps8
- Replies: 2
- Views: 2621
Re: Error in routine set_u_matrix (1): |xaxis| < eps8
Dear H. Lee, Thanks a lot for your advice. I found the error is related to the inconsistent of these parameters: ... nbndsub = 10 ... proj(1) = 'Al:sp3' proj(2) = 'N:sp3' ... I used an AlN unit cell model containing 2 Al and 2 N atoms, after I changed nbndsub = 16, this error was fixed. Below is the...
- Mon Feb 06, 2023 9:12 am
- Forum: Running the code
- Topic: Error in routine set_u_matrix (1): |xaxis| < eps8
- Replies: 2
- Views: 2621
Error in routine set_u_matrix (1): |xaxis| < eps8
Dear all, I'm trying to perform a mobility calculation with QE-7.0+EPW-5.5. I followed the "GaN-II tutorial", but I got an error of "Error in routine set_u_matrix (1): |xaxis| < eps8" in the step of EPW calculation. However, I couldn't find the problem in this error message, could you help me to fin...