[Pw_forum] DMFT+LDA

Dmitry Korotin dmitry at korotin.name
Wed Mar 25 09:17:41 CET 2009


2009/3/25 DdrSmiLe <ddrsmile at gmail.com>:
> Dear All
> I am using dmft package recently.
> I want to konw how to creat wannier_ham.x
> I could not find this executable anywhere after I compiled dmft.

You need to download  CVS version of QE and 'make pp'.
>
> Another problem is I could not compile w90 in espresso-4.1CVS package.
> It showed that there are something loss in W90 package.
>
> Thank you much
>
> NTLiu
> 2009/3/23 Dmitry Korotin <dmitry at korotin.name>
>>
>> Dear S.K. Saha,
>> LDA+DMFT project for QE already started and the first working code is
>> released. It strongly depends on QE source (uses QE make.sys files),
>> contains only one example (and minimal documentation). But it works.
>> Official LDA+DMFT for QE project site is
>> http://qe-forge.org/projects/dmft/. You can download files there.
>>
>> 2009/3/22 S. K. S. <sks.jnc at gmail.com>:
>> > Dear all,
>> > Recently, in abinit, I have seen
>> > some on-going developments  on DMFT+LDA.
>> > I'm a little curious. Has  anyone already started  or is
>> > going to start  the similar kind of developmental work in PWSCF????
>> > regards,
>> > S. K. Saha
>> > JNCASR
>> > Bangalore
>> > _______________________________________________
>> > Pw_forum mailing list
>> > Pw_forum at pwscf.org
>> > http://www.democritos.it/mailman/listinfo/pw_forum
>> >
>>
>>
>>
>> --
>> Best regards,
>> Dmitry Korotin
>>
>> Ph. D. Student,
>> Institute of Metal Physics
>> S. Kovalevskaya, 18
>> 620041 Ekaterinburg GSP-170
>> Russia
>> _______________________________________________
>> Pw_forum mailing list
>> Pw_forum at pwscf.org
>> http://www.democritos.it/mailman/listinfo/pw_forum
>
>
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>



-- 
С уважением,
Дмитрий Коротин

Best regards,
Dmitry Korotin

Ph. D. Student,
Institute of Metal Physics
S. Kovalevskaya, 18
620041 Ekaterinburg GSP-170
Russia



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