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Multistep Intersystem Crossing Pathways in Cinnamate-Based UV-B Sunscreens.
Yamazaki K, Miyazaki Y, Harabuchi Y, Taketsugu T, Maeda S, Inokuchi Y, Kinoshita SN, Sumida M, Onitsuka Y, Kohguchi H, Ehara M, Ebata T. Yamazaki K, et al. Among authors: maeda s. J Phys Chem Lett. 2016 Oct 6;7(19):4001-4007. doi: 10.1021/acs.jpclett.6b01643. Epub 2016 Sep 28. J Phys Chem Lett. 2016. PMID: 27657500
Global mapping of equilibrium and transition structures on potential energy surfaces by the scaled hypersphere search method: applications to ab initio surfaces of formaldehyde and propyne molecules.
Maeda S, Ohno K. Maeda S, et al. J Phys Chem A. 2005 Jun 30;109(25):5742-53. doi: 10.1021/jp0513162. J Phys Chem A. 2005. PMID: 16833907
Technical details of a new global mapping technique for finding equilibrium (EQ) and transition structures (TS) on potential energy surfaces (PES), the scaled hypersphere search (SHS) method (Ohno, K.; Maeda, S. Chem. Phys. Lett. 2004, 384, 277), are presented. On t …
Technical details of a new global mapping technique for finding equilibrium (EQ) and transition structures (TS) on potential energy surfaces …
4,010 results