[QE-users] ph.x

sara memarzadeh sm_ir59 at yahoo.com
Mon Apr 27 08:55:36 CEST 2020


 

Dear Users and Developers,

 I have a questionabout new tool, ph.x, in quantum espresso. I found that all examples use the'U_projection_type = ortho-atomic' and there is a sentence in reference paper"we have used atomic orbitals which were orthogonalized using Lowdin’smethod". Does the ph.x code works with atomic wave functions projection('U_projection_type = atomic' )?

 Best regards,

 Sara Memarzadeh

PhD student of solid state Physics,

Ferdwosi University of Mashhad, Mashhad, Iran.

-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20200427/50cdc7ca/attachment.html>


More information about the users mailing list