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Re: [abinit-forum] Help for Generation of Atomic PAW files


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  • From: g930102@ccit.edu.tw
  • To: <forum@abinit.org>
  • Subject: Re: [abinit-forum] Help for Generation of Atomic PAW files
  • Date: Thu, 4 Sep 2003 01:09:55 +0800 (CST)

Dear Dr. Yurii,

Thanks for your response and information.

The codes that I have mentioned before, you could get from this way.

Atompaw2abinit source code
(http://www.abinit.org/ABINIT/AtomPAW2Abinit-Manual-html/AtomPAW2Abinit.tar.gz),


Please read this URL(http://www.abinit.org/)

AtomPaw & PwPaw source code
(http://www.wfu.edu/~natalie/papers/pwpaw/update070903.tar.gz),

Please read this URL(http://www.wfu.edu/~natalie/papers/pwpaw/man.html)

Best regards,

Lu Fu-Fa

>I deal with PAW PP in VASP package. It work well with 3-d
>transition metal (Ni,Cu). I may try check your makefile and
>generated PAW PP by it, if you point out me where I can find
>Atompaw2abinit, AtomPaw and PwPaw source code. I work on Pentium 3
>in LINUX Red Hat 7.3 with Intel and PGI compilers. The PAW PP
>in VASP package are used in digital form and all chemical elements
>up to Z=80 are tabulated.

>Best regards,

>Yurii


___________________________________
NOCC, http://nocc.sourceforge.net




  • Re: [abinit-forum] Help for Generation of Atomic PAW files, g930102, 09/03/2003

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