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Re: [abinit-forum] how to visualize phonon eigenvectors after linear response calculation????????
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- From: Emmanuel Arras <emmanuel.arras@cea.fr>
- To: forum@abinit.org
- Subject: Re: [abinit-forum] how to visualize phonon eigenvectors after linear response calculation????????
- Date: Mon, 02 Nov 2009 19:51:47 +0100
Yeah, that's a bug in the writing. Go to the annaddb.out file then (you
must have put eivec variable to 1 ou 2). The way it is written is quite explicite. Don't make my mistake however, and first read a "basic textbook" on solid state physics and phonon. For exemple, CHAPTER 3 of "Theoretical Solid State Physics, Vol.1: Perfect Lattices in Equilibrium" by William Jones and Norman H. March. (see topic : "phonons atomique displacements, complexe phase and amplitude" ) Good luck Emmanuel Abedalhasan Breidi a écrit : SNT123-W55A959678F9AA7B2040BCE91B30@phx.gbl" type="cite"> all what is there in PHVEC file is this three following lines: -- Emmanuel ARRAS L_Sim (Laboratoire de Simulation Atomistique) SP2M / INAC CEA Grenoble tel : 00 33 (0)4 387 86862 |
- [abinit-forum] how to visualize phonon eigenvectors after linear response calculation????????, Abedalhasan Breidi, 11/01/2009
- Re: [abinit-forum] how to visualize phonon eigenvectors after linear response calculation????????, Emmanuel Arras, 11/02/2009
- RE: [abinit-forum] how to visualize phonon eigenvectors after linear response calculation????????, Abedalhasan Breidi, 11/02/2009
- Re: [abinit-forum] how to visualize phonon eigenvectors after linear response calculation????????, Emmanuel Arras, 11/02/2009
- RE: [abinit-forum] how to visualize phonon eigenvectors after linear response calculation????????, Abedalhasan Breidi, 11/02/2009
- Re: [abinit-forum] how to visualize phonon eigenvectors after linear response calculation????????, Emmanuel Arras, 11/02/2009
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