Matches in SemOpenAlex for { <https://semopenalex.org/work/W4306757322> ?p ?o ?g. }
- W4306757322 abstract "Abstract Interfaces, the boundary that separates two or more chemical compositions and/or phases of matter, alters basic chemical and physical properties including the thermodynamics of selectivity, transition states, and pathways of chemical reactions, nucleation events and phase growth, and kinetic barriers and mechanisms for mass transport and heat transport. While progress has been made in advancing more interface‐sensitive experimental approaches, their interpretation requires new theoretical methods and models that in turn can further elaborate on the microscopic physics that make interfacial chemistry so unique compared to the bulk phase. In this review, we describe some of the most recent theoretical efforts in modeling interfaces, and what has been learned about the transport and chemical transformations that occur at the air–liquid and solid–liquid interfaces. This article is categorized under: Structure and Mechanism > Reaction Mechanisms and Catalysis Structure and Mechanism > Computational Materials Science Software > Quantum Chemistry Software > Simulation Methods" @default.
- W4306757322 created "2022-10-19" @default.
- W4306757322 creator A5038765583 @default.
- W4306757322 creator A5055715892 @default.
- W4306757322 creator A5056814590 @default.
- W4306757322 creator A5062660977 @default.
- W4306757322 creator A5065820063 @default.
- W4306757322 creator A5069647057 @default.
- W4306757322 date "2022-10-18" @default.
- W4306757322 modified "2023-10-17" @default.
- W4306757322 title "Chemical transformations and transport phenomena at interfaces" @default.
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