Catalysts by design: The power of theory

Sharon Hammes-Schiffer

Research output: Contribution to journalReview articlepeer-review

Abstract

Theoretical design of effective catalysts, in conjunction with the identification of guiding design principles and strategies, is a Holy Grail in Chemistry. Although further progress will benefit from additional computational advances, theoretical studies have already enhanced the design of molecular electrocatalysts, photocatalysts, and enzymes.

Original languageEnglish (US)
Pages (from-to)561-566
Number of pages6
JournalAccounts of chemical research
Volume50
Issue number3
DOIs
StatePublished - 2017

ASJC Scopus subject areas

  • Chemistry(all)

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