[Pw_forum] Gaussian/Lorentzian broadening

[Claudio A. Perottoni]

Amin,

You may try tabprn95.exe 
(hanicka.uochb.cas.cz/~bour/programs/list.html). The program ask for an 
input file which is simply a list of mode number, frequency and relative 
intensities (three column ascii file). It should run on a linux machine 
using wine.

Good luck!

Claudio

On 23-Mar-15 18:19, Amin Torabi wrote:
> I'v used ph.x to calculate some Raman/IR spectra, and now I'd like to 
> dress them up using Gaussian/Lorentzian broadening?
>
> Any suggestion?
>
> -- 
> **********************************
> Amin Torabi
> Ph.D. Candidate
> Department of Chemistry
> University of Western Ontario
> **********************************
>
> Enviado via UCSMail.
>
>
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> Pw_forum at pwscf.org
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-- 
******************************************************************
Claudio A. Perottoni

Universidade de Caxias do Sul
IMC - Instituto de Materiais Ceramicos
Rua Irmao Moretto, 75
95765-000  Bom Principio - RS - Brazil
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