Kinetics and DFT studies on water oxidation by Ce4+ catalyzed by [Ru(terpy)(bpy)(OH2)]2+

Ayano Kimoto; Kosei Yamauchi; Masaki Yoshida; Shigeyuki Masaoka; Ken Sakai

doi:10.1039/c1cc15109f

Kinetics and DFT studies on water oxidation by Ce⁴⁺ catalyzed by [Ru(terpy)(bpy)(OH₂)]²⁺

Ayano Kimoto, Kosei Yamauchi, Masaki Yoshida, Shigeyuki Masaoka, Ken Sakai

Inorganic and Analytical Chemistry

Research output: Contribution to journal › Article › peer-review

88 Citations (Scopus)

Abstract

The Ru^VO species and other intermediates in O₂ evolution from water catalyzed by [Ru(terpy)(bpy)(OH₂)]²⁺ were spectrophotometrically characterized, and the spectral components observed were identified based on the TD-DFT calculations. Moreover, important insights into the rapid paths after the RDS were given by the DFT studies.

Original language	English
Pages (from-to)	239-241
Number of pages	3
Journal	Chemical Communications
Volume	48
Issue number	2
DOIs	https://doi.org/10.1039/c1cc15109f
Publication status	Published - Nov 30 2012

All Science Journal Classification (ASJC) codes

Catalysis
Electronic, Optical and Magnetic Materials
Ceramics and Composites
Chemistry(all)
Surfaces, Coatings and Films
Metals and Alloys
Materials Chemistry

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abstract = "The RuVO species and other intermediates in O2 evolution from water catalyzed by [Ru(terpy)(bpy)(OH2)]2+ were spectrophotometrically characterized, and the spectral components observed were identified based on the TD-DFT calculations. Moreover, important insights into the rapid paths after the RDS were given by the DFT studies.",

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AU - Sakai, Ken

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AB - The RuVO species and other intermediates in O2 evolution from water catalyzed by [Ru(terpy)(bpy)(OH2)]2+ were spectrophotometrically characterized, and the spectral components observed were identified based on the TD-DFT calculations. Moreover, important insights into the rapid paths after the RDS were given by the DFT studies.

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Kinetics and DFT studies on water oxidation by Ce⁴⁺ catalyzed by [Ru(terpy)(bpy)(OH₂)]²⁺

Abstract

All Science Journal Classification (ASJC) codes

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