LE&QR
收藏NIAID Data Ecosystem2026-03-12 收录
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资源简介：
The dataset consists of 45144 D1-D2-A models, characterized by the energy gap and the electronic coupling (J) between D1 and D2 and the frequency and Huang-Rhys factor (\Sigma) of the intramolecular vibrational mode serving as a vibronic ratchet. The dataset contains the calculated values of the acceptor yields at 1 ps (A_1ps) for each of these models.
创建时间：
2021-08-17
