Describe the new feature:
Goal would be for a user to continue a calculation that got terminated on a server. As far as I am aware, this has to be done manually so far.
How would you implement this feature?
Have saved checkpoint files for required parameters (Ham, wfn, lambda value, etc.). FanPT could have a method or a separate utility function that would look for these files in the folder and set up the FanPT class and continue the optimization.
Additional comments:
No response
Describe the new feature:
Goal would be for a user to continue a calculation that got terminated on a server. As far as I am aware, this has to be done manually so far.
How would you implement this feature?
Have saved checkpoint files for required parameters (Ham, wfn, lambda value, etc.). FanPT could have a method or a separate utility function that would look for these files in the folder and set up the FanPT class and continue the optimization.
Additional comments:
No response