forum@abinit.org
Subject: The ABINIT Users Mailing List ( CLOSED )
List archive
- From: "Kwan-Woo Lee" <kwlee@ucdavis.edu>
- To: Xavier Gonze <gonze@pcpm.ucl.ac.be>, forum@abinit.org
- Subject: Re: [abinit-forum] unit of oscillator strengths?
- Date: Sat, 8 Feb 2003 19:43:29 -0800 (PST)
Dear Xavier Gonze,
Iam very appreciating for your kind response, always.
Because here is nobody having used ABINIT by me, I asked to you with
(sometimes) stupid questions serveral times.
Thanks to your help, I could cope with problems.
thank you again,
Kwan-Woo Lee
> Dear Kwan-Woo Lee,
>
> Kwan-Woo Lee wrote:
> > Dear all,
> >
> > Is there anyone knowing the unit of Oscillator strengths (and eigen
> > vectors) obatined
> > from IFC ?
> > I cannot find the information about it in ABINIT package and homepage.
> > (From the paper PRB. 55,10355(1996) by Xavier Gonze and Changyol Lee,
It
> > looks like both may not be dimesionless.)
>
> Atomic units are used in that paper : 1 atomic unit for
> the oscillator strength is
> 0.342036 m3/s2 (my thanks to Gian-Marco !). THis information
> will be placed in the output file.
> The phonon eigenvectors are normalized according to Eq.(51)
> of that paper (thus the dimension is apparently the inverse square root
> of an atomic mass). Do not forget that a normalisation is a convention !
>
> Good continuation,
> Xavier
>
- Re: [abinit-forum] unit of oscillator strengths?, Kwan-Woo Lee, 02/09/2003
Archive powered by MHonArc 2.6.16.