TURBOMOLE Users Forum

TURBOMOLE Modules => Ricc2 => Topic started by: evgeniy on June 15, 2016, 01:52:18 PM

Title: Restarting cc2/adc(2) excited state calculations
Post by: evgeniy on June 15, 2016, 01:52:18 PM

Hello,

I have a short question concerning restarting cc2 and adc(2) calculations for excited states:
can both types of calculations, i.e. cc2 and adc(2), be restarted?
is some special keywords/option are needed in the control file for that?
Many thanks!

Best regards,
EVgeniy

Title: Re: Restarting cc2/adc(2) excited state calculations
Post by: christof.haettig on October 06, 2016, 05:55:11 PM

They can both be restarted.

But the restart flag into $ricc2 and provide the CC* files in the start directory and the program will try to figure out from where it can restart.

Christof