[QE-users] visualising vibrations from the results of phonon calculations
Yohei Uemura
yohei.uemura at gmail.com
Mon Sep 30 15:59:50 CEST 2019
Dear users,
I'm new for quantum espresso (phonon.x).
I calculated the vibrations of CO2 or CH4.
I would like to visualise the motion of atoms in CO2 or CH4.
As someone discussed before, XCrysDen did not work to show the motions of
atoms.("[Pw_forum] Phonon axsf does not move in XCrysden")
Does anyone know how to visualise the motions of atoms?
I have the output file from dynmat.x.
Best regards,
Yohei
--
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Yohei Uemura (Ph.D)
Affiliation : Paul Scherrer Institut (PSI),
Laboratory for Environmental Chemistry (LUC)
Address : OFLB 106 (PSI Ost), PSI, Forschungsstrasse 111,
5232 Villigen, Switzerland
Phone: +41 (0)5-6310-4571
上村洋平
所属 : Paul Scherrer Institut (PSI),
Laboratory for Environmental Chemistry (LUC)
住所 : OFLB 106 (PSI Ost), PSI, Forschungsstrasse 111,
5232 Villigen, Switzerland
電話 : +41 (0)5-6310-4571
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