Re: FATAL ERROR: UNABLE TO FIND ANGLE PARAMETERS FOR CT2 CT1 CT2 (ATOMS 107 98 100)

From: Jernej Zidar (jernej.zidar_at_gmail.com)
Date: Sun Oct 23 2011 - 19:45:56 CDT

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Hi
Che the parameter file for the triplet "CT2 CT1 CT2". The message you are receiving indicates the triplet is most likely missing.

What to do if the bond triplet is missing i.e. the bond parameters are missing? Try finding a similar triplet. You may have to change the atom types.

Regards,
Jernej

On 24. okt. 2011, at 03:39, Jens K. Munk wrote:

>
> Then comes the mentioned error:
>
> FATAL ERROR: UNABLE TO FIND ANGLE PARAMETERS FOR CT2 CT1 CT2 (ATOMS 107 98 100)

Next message: 常姗燕 : "What is the proper value of TMDk in TMD simulations?"
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Next in thread: johan strumpfer: "Re: FATAL ERROR: UNABLE TO FIND ANGLE PARAMETERS FOR CT2 CT1 CT2 (ATOMS 107 98 100)"
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