Hello All, VASP specifies wigner seitz radius (for example, 2.8 a.u.) in PAW file.
How does QE choose this radius for KJPAW ? Where is the chosen value for this radius printed in QE ? Is this allowed to vary this radius to tune a specific property ? Any helpful comment is fully appreciated in advance. Yours sincerely, Suza W Research Associate, DMS, Bangalore. -------------- next part -------------- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20140926/f62c2c15/attachment.html
