[CP2K:8029] How to open results of Vibrational analysis with molden

S Ling lingsa... at gmail.com
Tue Aug 2 09:47:43 UTC 2016


Just type "molden C6H6-VIBRATIONAL-1.mol" from the terminal if you are
using Linux/Mac. Once you open the file, to visualise individual normal
mode, please click on the tab next to "Norm. Mode" in the main menu of
Molden.

SL

On 2 August 2016 at 09:16, Shun <syun39y... at gmail.com> wrote:

>
> Hi, I am a beginner of CP2K and trying to calculate IR spectra with the
> function of Vibration analysis according to the web-page:
> https://www.cp2k.org/exercises:2016_ethz_mmm:infra_red
> after calculation, I tried to open the C6H6-VIBRATIONAL-1.mol with molden
> and I cannot.
> Please let me know how to open the attached file with molden or another
> software.
>
> Shun
>
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