Menu

Discussion Forum

New Discussion
Filter

Discussion Closed This discussion was created more than 6 months ago and has been closed. To start a new discussion with a link back to this one, click here.

Calculating Density of States and Band Gap of Diamond Crystal Structure

Posted Jun 22, 2016, 10:37 a.m. EDT Version 4.3b, Version 4.4, Version 5.0 1 Reply

Shade
Send Private Message Flag post as spam

Please login with a confirmed email address before reporting spam

Can anyone in this forum tell me if COMSOL can calculate density of states and band gap of a crystal structure.

Thank you
1 Reply Last Post Jun 23, 2016, 11:00 a.m. EDT
Daniel Connelly
Send Private Message Flag post as spam

Please login with a confirmed email address before reporting spam

Posted: 8 years ago Jun 23, 2016, 11:00 a.m. EDT
Yes -- write a library function to have COMSOL call VASP or Quantum Espresso :).

Yes -- write a library function to have COMSOL call VASP or Quantum Espresso :).

Note that while COMSOL employees may participate in the discussion forum, COMSOL® software users who are on-subscription should submit their questions via the Support Center for a more comprehensive response from the Technical Support team.

Suggested Content