[QE-users] Magnetic Field

2019-08-26 Thread Anuja Chanana
Dear all, Is there a good methodology to apply an external magnetic field on a slab using Quantum Espresso? Thanks and Regards Anuja Chanana JNCASR [image: Mailtrack] Sender notified by Mailtrack

Re: [QE-users] Unable to calculate correct Point group and Character Table

2019-08-26 Thread Paolo Giannozzi
If you want to be sure to get the correct symmetry, use the space group number and Wyckoff positions. Otherwise, use a sufficiently large number of significant digits. Paolo On Fri, Aug 23, 2019 at 9:34 PM Ankit Sharma wrote: > Hi, > While running dft calculations for Gallium oxide, I found

Re: [QE-users] Dear EPW team

2019-08-26 Thread Christoph Wolf
Dear Aijun, I am not a developer but most of the support for EPW is done via the messaging board (forum) at http://epwforum.uk/index.php there is no integrated plot utility for the spectral functions but you can plot it via matlab, python or even gnuplot once you understand the format HTH!