3 Questions 4 Answers 0 Followers
Questions related from Zhibo Liu
Hello I am trying to follow Olson's theory of electron transfer (Ion-Ion Recombination Total Cross Sections-Atomic Species 1970) using Gaussian for ion pair of N+ & O-. However, the result of...
16 December 2021 3,670 2 View
Hello, I am trying to get an estimate of electron transfer rate between ions and it seems like Marcus theory is recommended by a lot of people. For the lambda term or reorganization energy part of...
04 November 2021 3,038 2 View
I am trying to use Gaussian 09 to get the reorganization energy between SF6+/- ion pairs assuming no solvent or vacuum with a 4-points calculation. I have noticed that the result I got is a...
04 November 2021 6,246 1 View
