The Structure and Proton Transport Mechanisms in the Superprotonic Phase of CsH2PO4: An Ab Initio Molecular Dynamics Study-Reference-Cited by-同舟云学术

The Structure and Proton Transport Mechanisms in the Superprotonic Phase of CsH2PO4: An Ab Initio Molecular Dynamics Study

Published:2008-06-11 Issue:26 Volume:112 Page:9917-9930
ISSN:1932-7447
Container-title:The Journal of Physical Chemistry C
language:en
Short-container-title:J. Phys. Chem. C

Author:

Lee Hee-Seung¹,Tuckerman Mark E.¹

Affiliation:

1. Department of Chemistry, New York University, New York, New York 10003, Department of Chemistry and Biochemistry, University of North Carolina, Wilmington, North Carolina 28403, and Courant Institute of Mathematical Sciences, New York University, New York, New York 10003

Publisher

American Chemical Society (ACS)

Subject

Surfaces, Coatings and Films,Physical and Theoretical Chemistry,General Energy,Electronic, Optical and Magnetic Materials

Link

https://pubs.acs.org/doi/pdf/10.1021/jp800342y

Reference78 articles.

1. Proton conduction and injection in solids

2. On Solids with Liquidlike Properties and the Challenge To Develop New Proton-Conducting Separator Materials for Intermediate-Temperature Fuel Cells

3. What Are Batteries, Fuel Cells, and Supercapacitors?

4. Transport in Proton Conductors for Fuel-Cell Applications: Simulations, Elementary Reactions, and Phenomenology

Cited by 44 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Coexistence of Cationic and Anionic Phosphate Moieties in Solids: Unusual but Not Impossible;The Journal of Physical Chemistry Letters;2023-08-08

2. Molecular dynamics simulations of proton conducting media containing phosphoric acid;Physical Chemistry Chemical Physics;2022

3. Vibrational spectroscopy and molecular dynamics simulation of choline oxyanions salts;Journal of Molecular Liquids;2021-10

4. Characterizing and Contrasting Structural Proton Transport Mechanisms in Azole Hydrogen Bond Networks Using Ab Initio Molecular Dynamics;The Journal of Physical Chemistry Letters;2021-09-03

5. Phase Transition Study of Thermal Dependence of Soft Mode Frequency, Dielectric Constant and Dielectric Tangent Loss Properties in CsH2PO4 (CDP) and CsD2PO4 (DCDP) Crystals;Journal of Low Temperature Physics;2021-04-09