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

Dinesh Yadav yadavdk072 at gmail.com
Mon Sep 24 17:09:53 CEST 2018


Dear Gavin Abo,
    Thank you for your reply.
Previous posts are very helpful.

Best Regards,
Dinesh Yadav


On Mon, Sep 24, 2018 at 9:53 AM Dinesh Yadav <yadavdk072 at gmail.com> wrote:

> 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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