iRASPA Community

RASPA => Simulation algorithms and theory => Topic started by: rshukre on October 25, 2020, 04:39:14 AM

Title: Simulated Annealing
Post by: rshukre on October 25, 2020, 04:39:14 AM
Does RASPA have the capability to do simulated Annealing? If so, how to specify the temperature range for annealing?
Title: Re: Simulated Annealing
Post by: David Dubbeldam on January 19, 2021, 07:22:56 PM
No, but you could achieve this with scripts. Just simulate at a certain temperature, and use the restart-file to restart at a lower temperature.