[CP2K-user] [CP2K:16774] The output file of VIBRATIONAL_ANALYSIS is marked with an asterisk

['李梦旭' via cp2k]

 Dear CP2K community, 
I am a complete beginner in using CP2K. I'm using PBE0+D3/aug-cc-pVDZ for  
geometry  optimization. The structure is one hydrogen ion and two water 
molecules. 
After geometry  optimization, I do VIBRATIONAL_ANALYSIS using optimized 
structure, because I want to know whether my structure is stable. If there 
is no imaginary frequency, I think my structure is OK. But in the output 
file of  VIBRATIONAL_ANALYSIS, there are many asterisks. 

VIB| 13 14 15
VIB|Frequency (cm^-1) 3851.241875 3870.236967 ************
VIB|Intensities 0.000000 0.000000 0.000000
VIB|Red.Masses (a.u.) 1.072537 1.086576 1.071116
VIB|Frc consts (a.u.) 0.604071 0.624141 ************

This are my input files, output files and optimized structure.  I don't 
know what went wrong
Can anyone give me some suggestions?  Any  suggestions are highly 
appreciated. 

Best,
Mengxu Li

-- 
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+unsubscribe at googlegroups.com.
To view this discussion on the web visit https://groups.google.com/d/msgid/cp2k/fa1884bc-249d-47e9-9008-a6f03d45c5e7n%40googlegroups.com.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20220326/c62c2dc4/attachment-0001.htm>
-------------- next part --------------
A non-text attachment was scrubbed...
Name: H-H2O-2-opt.out.out
Type: application/octet-stream
Size: 258477 bytes
Desc: not available
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20220326/c62c2dc4/attachment-0001.obj>
-------------- next part --------------
A non-text attachment was scrubbed...
Name: H-H2O-2-cp2k.zip
Type: application/x-zip
Size: 55534 bytes
Desc: not available
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20220326/c62c2dc4/attachment-0001.bin>
-------------- next part --------------
A non-text attachment was scrubbed...
Name: H-H2O-2-opt.inp.inp
Type: chemical/x-gamess-input
Size: 1601 bytes
Desc: not available
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20220326/c62c2dc4/attachment-0001.inp>