Effect of bound state of water on hydronium ion mobility in hydrated Nafion using molecular dynamics simulations

Large-scale atomistic and quantum-mechanical simulations of a Nafion membrane: Morphology, proton solvation and charge transport

(2013) Pavel V Komarov et al.   Beilstein Journal of Nanotechnology

Molecular Simulation of Gas Adsorption, Diffusion, and Permeation in Hydrated Nafion Membranes

(2011) Shuai Ban et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Proton Solvation and Transport in Hydrated Nafion

(2011) Shulu Feng et al.   JOURNAL OF PHYSICAL CHEMISTRY B

A Refined MS-EVB Model for Proton Transport in Aqueous Environments

(2011) Kyoyeon Park et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Simulation study of the equilibrium morphology in ionomers with different architectures

(2011) Elshad Allahyarov et al.   JOURNAL OF POLYMER SCIENCE PART B-POLYMER PHYSICS

An ab initio study of the primary hydration and proton transfer of CF3SO3H and CF3O(CF2)2SO3H: Effects of the hybrid functional and inclusion of diffuse functions

(2011) Chen Wang et al.   SOLID STATE IONICS

A review of polymer electrolyte membrane fuel cells: Technology, applications, and needs on fundamental research

(2010) Yun Wang et al.   APPLIED ENERGY

Atomistic Simulation of Water Percolation and Proton Hopping in Nafion Fuel Cell Membrane

(2010) Ram Devanathan et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Molecular Dynamics Modeling of Proton Transport in Nafion and Hyflon Nanostructures

(2010) Jaanus Karo et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Probing Selected Morphological Models of Hydrated Nafion Using Large-Scale Molecular Dynamics Simulations

(2010) Craig K. Knox et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Nanophase segregation and water dynamics in hydrated Nafion: Molecular modeling and experimental validation

(2008) Kourosh Malek et al.   JOURNAL OF CHEMICAL PHYSICS

An Improved Multistate Empirical Valence Bond Model for Aqueous Proton Solvation and Transport†

(2007) Yujie Wu et al.   JOURNAL OF PHYSICAL CHEMISTRY B