[Wien] Hybrid funtional

[karima Physique]

Thank you very much

2017-06-11 8:43 GMT+02:00 <tran at theochem.tuwien.ac.at>:

> LDA+U, onsite hybrid, and full hybrid are all supposed to be
> better than normal LDA/GGA for correlated systems.
> It would not really make sense to mix them together.
>
> On Sunday 2017-06-11 04:33, karima Physique wrote:
>
> Date: Sun, 11 Jun 2017 04:33:38
>> From: karima Physique <physique.karima at gmail.com>
>> Reply-To: A Mailing list for WIEN2k users <wien at zeus.theochem.tuwien.ac.
>> at>
>> To: A Mailing list for WIEN2k users <wien at zeus.theochem.tuwien.ac.at>
>> Subject: [Wien] Hybrid funtional
>>
>> Dear wien2k users;
>>
>> Are the full hybrid funtional sufficient for the treatment of highly
>> correlated systems (use of full hybrid functional without the need to add
>> the hubbard
>> term).
>>
>>
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