Quantum-Chemical Calculations of a Long Proton Wire. Application of a Harmonic Model to Analysis of the Structure of an Ionic Defect in a Water Chain with an Excess Proton-Reference-Cited by-同舟云学术

Quantum-Chemical Calculations of a Long Proton Wire. Application of a Harmonic Model to Analysis of the Structure of an Ionic Defect in a Water Chain with an Excess Proton

Published:2010-01-19 Issue:5 Volume:114 Page:2201-2212
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Isaev Alexander N.¹

Affiliation:

1. N.D. Zelinsky Institute of Organic Chemistry, Russian Academy of Sciences, Leninsky pr. 47, 119991 Moscow, Russia

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp908259p

Reference76 articles.

1. Molecular mechanisms for proton transport in membranes.

2. The Grotthuss mechanism

3. The nature of the hydrated excess proton in water

4. Free Energy Profiles for H+ Conduction along Hydrogen-Bonded Chains of Water Molecules

5. Solvation and Hydrogen-Bonding Effects on Proton Wires

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