Double-proton-transfer in [2,2′-bipyridine]-3,3′-diol: an ab initio study
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference32 articles.
1. New proton transfer lasing systems—derivatives of 2,2′-bipyridyl. Synthesis and photophysical characteristics
2. Photodetermination and photostabilization of coatings;Werner,1986
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