[Wien] High-spin, Low-spin calculations.

Dinesh Yadav yadavdk072 at gmail.com
Mon Sep 24 06:08:23 CEST 2018


Dear Gavin Abo,

Thank you for your kind reply.

My problem is similar to this mailing list  and paper respectively,

https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg14234.html

http://sci-hub.tw/https://journals.aps.org/prb/abstract/10.1103/PhysRevB.81.115127

On Sun, Sep 23, 2018 at 11:52 PM Dinesh Yadav <yadavdk072 at gmail.com> wrote:

> Dear wien2k users,
>      How to calculate for High-spin, intermediate spin and low-spin
> configuration.
> Thanks in advance !!
>
> Dinesh Yadav
> Tribhuvan University
> Kathmandu, Nepal
>
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