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Re^2: Calculate of TDDFT

guilherme
guycanella@gmail.com


Hi Alex,

thank you for your tip!! Now the problem is solved!


---------------------------------------------
>Hi,

>add

>
> $contrl inttyp=hondo $end
>

>to your input.

>Kind regards,
>Alex Granovsky
>
>
>On Fri Dec 6 '13 0:14am, guilherme wrote
>----------------------------------------
>>Hi guys, I have a problem to calculate the TDDFt of benzoic acid. I ran the same processess to benzene and piridine but fot the benzoic acid the calculate don't converged.

>>Please, take a look in my input and output.


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