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Re: TDDFT gradients

Alex Granovsky

Dear Jonas,

I'd be glad to provide you beta version of Firefly with TDDFT gradient programmed; unfortunately we do not have such a version as of now.

Alex Granovsky

On Wed Jul 13 '11 4:51am, Jonas Baltrusaitis wrote
>I figured those were under development, maybe I could get binaries for testing as I wouldn;t mind to do TDDFT optimization with state tracking



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