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Re^2: Punching Hessian during geometry optimization


Dear Alex,

Many thanks! The idump/irest options are indeed useful.

Best regards,

On Mon Oct 31 '16 11:07pm, Alex Granovsky wrote

>There is no such option presently but I can consider to add it
>if needed.

>Note, for ISC and CoIn location jobs, the best way to restart is
>to use idump/irest options in $statpt group.

>Best regards,
>Alex Granovsky
>On Mon Oct 31 '16 6:50pm, GrEv wrote

>>I wonder if it is possible to punch an approximate Hessian every N-th step during optimization?

>>Best regards,

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