[Pw_forum] Fwd: visualization
germaneau at sjtu.edu.cn
Tue Jul 8 08:44:10 CEST 2014
yes it is.
You have to compute the electronic density, then xcrysden allows you to
display it along with the atomic structure.
On 07/07/2014 07:05 PM, yelena wrote:
> Since I cannot send email to xcrysden message-board, I'm forwarding it
> Dear everyone,
> I have been using QE for sometime but I used XCrysden just for simple
> I've come across image in one paper and I'm very interested to know is
> that image made by xcrysden and how (just name of method, or tutorial
> if there is one... etc.)
> Publication is:
> Calandra, M., Profeta, G. and Mauri, F. (2012), Superconductivity in
> metal-coated graphene. Phys. Status Solidi B, 249: 2544–2548. doi:
> and I attached image I am asking advice about.
> Best regards,
> PhD Student J. Pesic
> Center for Solid State Physics and New Materials,
> Institute of Physics Belgrade, Serbia
> Pw_forum mailing list
> Pw_forum at pwscf.org
Éric Germaneau (艾海克), Specialist
Center for High Performance Computing
Shanghai Jiao Tong University
Room 205 Network Center, 800 Dongchuan Road, Shanghai 200240 China
M:germaneau at sjtu.edu.cn P:+86-136-4161-6480 W:http://hpc.sjtu.edu.cn
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