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Effect of the Locally Excited State on Symmetry-Breaking Charge Transfer and Transition Dipole Moment in Quadrupolar Molecules with Inverse Level Order

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The symmetry-breaking charge transfer (SBCT) in quadrupolar molecules with normal and inverse level orders (LOs) (the lowest excited state is odd or even) is theoretically investigated. The effect of the locally excited state (LES) on SBCT and the transition d... ...