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Prof. Blaha,<br>
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Thank you for your quick answer</div>
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Pablo<br>
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<div id="divRplyFwdMsg" dir="ltr"><font face="Calibri, sans-serif" style="font-size:11pt" color="#000000"><b>De:</b> Wien <wien-bounces@zeus.theochem.tuwien.ac.at> en nombre de Peter Blaha <peter.blaha@tuwien.ac.at><br>
<b>Enviado:</b> viernes, 31 de marzo de 2023 11:14 a. m.<br>
<b>Para:</b> wien@zeus.theochem.tuwien.ac.at <wien@zeus.theochem.tuwien.ac.at><br>
<b>Asunto:</b> Re: [Wien] LDA+U</font>
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<div class="PlainText">The term "LDA+U" has historic reasons.<br>
Of course you can use GGAs (or mGGA) + U.<br>
<br>
Am 31.03.2023 um 19:02 schrieb delamora:<br>
> WIEN2k community,<br>
> The Hubbard U is related in the Usersguide as LDA+U, does it mean that <br>
> it should be used with LDA and not with GGA?<br>
> <br>
> I have always used the Hubbard U with GGA (PBE)<br>
> <br>
> Pablo<br>
> <br>
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-- <br>
--------------------------------------------------------------------------<br>
Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna<br>
Phone: +43-1-58801-165300<br>
Email: peter.blaha@tuwien.ac.at WIEN2k: <a href="http://www.wien2k.at">http://www.wien2k.at</a><br>
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