[Orca-users] gradient difference in mecp

[Blair Zajac]

Hello,

This Orca mailing list isn’t for that Orca program. It’s for the one that generates plots like these:

https://www.orcaware.com/orca/

Regards,
Blair

> On Feb 10, 2016, at 6:20 AM, silmar.monte <silmar.monte at uol.com.br> wrote:
> 
> Dear Orca users,
>  
> I have performed a MECP (minimum energy crossing point) calculation and in the output file the gradient difference between the two states (at the optimized MECP) is not printed. However, the norm of gradient is printed. Is this actually the norm of gradient difference vector  ?
> Thank you for your help.
>  
> Silmar Andrade
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