Date typo in PBE.64 Nd POTCAR Header

Problems running VASP: crashes, internal errors, "wrong" results.


Moderators: Global Moderator, Moderator

Locked
Message
Author
marykate_
Newbie
Newbie
Posts: 4
Joined: Wed Dec 01, 2021 1:35 pm

Date typo in PBE.64 Nd POTCAR Header

#1 Post by marykate_ » Wed Oct 25, 2023 12:42 pm

This isn't a bug per se, but in case you weren't already aware, there is a typo in the first line of the Nd POTCAR for the new PBE version 64 release. It reads "PAW_PBE Nd 25May2002" instead of "PAW_PBE Nd 25May2022". It's not entirely important, but I noticed it when comparing the dates of the Nd POTCAR from the PBE version 54, which was "PAW_PBE Nd 23Dec2003", and had a brief moment of thinking an earlier generation of the Nd pseudopotential was used in the most recent release.

Thank you for updating the lanthanide PAW POTCAR files!

Sincerely,
Mary Kate

marie-therese.huebsch
Full Member
Full Member
Posts: 212
Joined: Tue Jan 19, 2021 12:01 am

Re: Date typo in PBE.64 Nd POTCAR Header

#2 Post by marie-therese.huebsch » Wed Nov 01, 2023 11:24 am

Hi Mary Kate,

Thank you for pointing it out!
I can confirm that this is a typo. Fortunately, for the other lanthanides, it correctly reads 25May2022.

Cheers,
Marie-Therese

Locked