Publicación

Coherence in chemistry: Foundations and frontiers

Jonathan D. Schultz · Schultz J.D. · Jonathon L. Yuly · Yuly J.L. · Eric A. Arsenault · Arsenault E.A. · Kelsey A. Parker · Parker K. · Sutirtha N. Chowdhury · Chowdhury S.N.

Resumen

Coherence refers to correlations in waves. Because matter has a wave-particle nature, it is unsurprising that coherence has deep connections with the most contemporary issues in chemistry research (e.g., energy harvesting, femtosecond spectroscopy, molecular qubits and more). But what does the word “coherence” really mean in the context of molecules and other quantum systems? We provide a review of key concepts, definitions, and methodologies, surrounding coherence phenomena in chemistry, and we describe how the terms “coherence” and “quantum coherence” refer to many different phenomena in chemistry. Moreover, we show how these notions are related to the concept of an interference pattern. Coherence phenomena are indeed complex, and ambiguous definitions may spawn confusion. By describing the many definitions and contexts for coherence in the molecular sciences, we aim to enhance understanding and communication in this broad and active area of chemistry.

Autores y colaboradores

Authors

Jonathan D. Schultz
Schultz J.D.
Jonathon L. Yuly
Yuly J.L.
Eric A. Arsenault
Arsenault E.A.
Kelsey A. Parker
Parker K.
Sutirtha N. Chowdhury
Chowdhury S.N.

Palabras clave

Excitation-energy transfer 2-Dimensional electronic spectroscopy Light-harvesting complex Backward semiclassical dynamics Initial-value representation Polymer molecular-dynamics Quantum master equation Photosynthetic reaction centers Dissipative 2-level systems Path-integral calculation