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Studies of the ground and excited-state surfaces of the retinal chromophore using CAM-B3LYP

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Date

2010

Authors

Rostov, Ivan
Amos, Roger
Kobayashi, Rika
Scalmani, Giovanni
Frisch, Michael J

Journal Title

Journal ISSN

Volume Title

Publisher

American Chemical Society

Abstract

The isomerization of the 11-cis isomer (PSB11) of the retinal chromophore to its all-trans isomer (PSBT) is examined. Optimized structures on both the ground state and the excited state are calculated, and the dependence on torsional angles in the carbon

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Citation

URI

http://hdl.handle.net/1885/63557

Collections

Open Access Research

Source

Journal of Physical Chemistry B

Type

Journal article

Book Title

Entity type

Access Statement

License Rights

DOI

10.1021/jp911329g

Restricted until

2037-12-31

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01_Rostov_Studies_of_the_ground_and_2010.pdf (380.39 KB)

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