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- From: Thomas Maxisch <Maxisch@MIT.EDU>
- To: forum@abinit.org
- Subject: Re: [abinit-forum] accoustic frequency for a metal
- Date: Tue, 13 Jul 2004 10:11:29 -0400
Dear Lee Geunsik,
Another aspect is that you may check that your k-point grid does not impose a higher symmetry.
Thus, even if ground state electron properties are correctly described, a too high symmetry might constrain your system leading to wrong phonon frequencies.
It might worth to break symmetry explicitly.
Thomas
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Thomas Maxisch
MIT-DMSE
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Email : Maxisch@mit.edu
__________________________________________________________________________
- accoustic frequency for a metal, Lee Geunsik, 07/13/2004
- Re: [abinit-forum] accoustic frequency for a metal, verstraete, 07/13/2004
- Re: [abinit-forum] accoustic frequency for a metal, Xavier Gonze, 07/13/2004
- Re: [abinit-forum] accoustic frequency for a metal, Thomas Maxisch, 07/13/2004
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