Theoretical Modelling as a Possible Tool in the Design of Photochromic Systems
作者:
M.A. Robb,
M.J. Bearpark,
P. Celani,
F. Bernardi,
M. Olivucci,
期刊:
Molecular Crystals and Liquid Crystals Science and Technology. Section A. Molecular Crystals and Liquid Crystals
(Taylor Available online 2000)
卷期:
Volume 344,
issue 1
页码: 31-39
ISSN:1058-725X
年代: 2000
DOI:10.1080/10587250008023811
出版商: Taylor & Francis Group
数据来源: Taylor
摘要:
In photochemical processes, the reactant resides on an excited state potential energy surface and the products accumulate on the ground state. Thus the reaction path must have at least two branches: one located on the excited state and the other located on the ground state energy surface. The novel feature of photochemistry is the “funnel” region where the excited state reactant or intermediate is delivered to the ground state.
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