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I wonder that how obtain the CT and LE contributions to excited state.
I saw the answer related to my question in this page and blog article, but I don't understand it.
Your blog article shows the MLCT percentages(based on the atomic charge) and it is the percentage of charge transfer between the two fragment in the electronic transition.
But I want to obtain the ratio of CT and LE (CT means the spatial seperation of hole and electron, LE means the hole and electron occupy similar spatial region).
I think what I want to obtain and your previous answer is different.
Could you please explain to me in this regard??
Pages: 1