[QE-users] Pseudopotentials

[Hari Paudyal]

Hi Dr. Zacharies,

I just tested the potential in case of graphene, it worked fine for me. I
used the recommended eutoffs from the potential and qe-6.3 version. I
wonder, if you have something problem downloading the potential correctly,
otherwise it should go fine, I guess.

Cheers,
Hari Paudyal
SUNY Binghamton, USA

On Wed, Sep 5, 2018 at 10:44 AM, Zacharias Fthenakis <
zfthenakis at mail.usf.edu> wrote:

> Is there any problem with pseudopotentials released recently (4 Sept.
> 2018)? I used copy and paste to get a copy of C.pbe-n-kjpaw_psl.1.0.0.UPF
> from https://www.quantum-espresso.org/pseudopotentials/ps-library/c in my
> account, but when I tried to run the code, it didn't work. I get the error
> message "Error in routine read_ncpp (5):      pseudo file is empty or
> wrong". Moreover, on top of the webpage there is the following message
> "This XML file does not appear to have any style information associated
> with it. The document tree is shown below." The corresponding
> pseudopotential for Cobalt, (Co.pbe-spn-kjpaw_psl.0.3.1.UPF) created in
> May 4, 2018 seems to work fine and the message for the XML file did not
> appear. Does anyone know what is going on?
>
>
>
> --
> -----------------------------------------------------------------------
> Dr Zacharias G. Fthenakis
> Research Associate
> Physics Department
> University of South Florida
> 4202 E Fowler Ave. ISA5119
> Tampa, FL, 33620, USA
> -----------------------------------------------------------------------
>
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