[CP2K:8029] How to open results of Vibrational analysis with molden
Shun
syun39y... at gmail.com
Tue Aug 2 10:52:13 UTC 2016
Hi S Ling
Thanks for your kind advice. Now I am looking for the "Norm. Mode" on the
molden control window, but I cannot find it out.
Please could you tell me why there is not the button on my window like
attached picture?
I use molden ver. 5.6.
Regards
Shun
2016年8月2日火曜日 11時47分45秒 UTC+2 S Ling:
>
> 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 <syun3... 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
>>
>> --
>> You received this message because you are subscribed to the Google Groups
>> "cp2k" group.
>> To unsubscribe from this group and stop receiving emails from it, send an
>> email to cp2k+... at googlegroups.com.
>> To post to this group, send email to cp... at googlegroups.com.
>> Visit this group at https://groups.google.com/group/cp2k.
>> For more options, visit https://groups.google.com/d/optout.
>>
>
>
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20160802/e653fdba/attachment.htm>
-------------- next part --------------
A non-text attachment was scrubbed...
Name: Screenshot.png
Type: image/png
Size: 13925 bytes
Desc: not available
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20160802/e653fdba/attachment.png>
More information about the CP2K-user
mailing list