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Re: [abinit-forum] corrections to do in linopt.F90 ?


Chronological Thread 
  • From: Xavier Gonze <gonze@pcpm.ucl.ac.be>
  • To: forum@abinit.org
  • Subject: Re: [abinit-forum] corrections to do in linopt.F90 ?
  • Date: Mon, 8 Oct 2007 07:52:17 +0200

Dear Herve,

You are right. Corrected in v5.4.4.

Best,
Xavier

On 21 Sep 2007, at 11:07, <herve.mathis@cea.fr> <herve.mathis@cea.fr> wrote:

Dear All,

I suppose there are two little errors in subroutine linopt.F90 (5.4.3 release) as regards Optic tool.

1) the 3 instructions “write(92,*) ‘Im(chi1) / Re(chi1) / Abs(chi1)’ should be replaced by

“write(92,*) ‘Im(eps) / Re(eps) / Abs(eps)’”

2) instruction “eps(iw) = 1 + 4pi chi1(iw)” should be replaced by “eps(iw) = 4pi chi1(iw)”

for non-diagonal components i.e. if v2.ne.v1

 
 




  • Re: [abinit-forum] corrections to do in linopt.F90 ?, Xavier Gonze, 10/08/2007

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