Molecular Dynamics Study of Ion Transport in Polymer Electrolytes of All-Solid-State Li-Ion Batteries

Parameter sensitivity analysis and cathode structure optimization of a non-aqueous Li–O2 battery model

(2020) Kai Jiang et al.   JOURNAL OF POWER SOURCES

Toward safe and rapid battery charging: Design optimal fast charging strategies thorough a physics‐based model considering lithium plating

(2020) Changhong Liu et al.   INTERNATIONAL JOURNAL OF ENERGY RESEARCH

Effects of water nanochannel diameter on proton transport in proton‐exchange membranes

(2019) Takuya Mabuchi et al.   JOURNAL OF POLYMER SCIENCE PART B-POLYMER PHYSICS

Numerical simulation of the factors affecting the growth of lithium dendrites

(2019) Wenyu Mu et al.   Journal of Energy Storage

Relationship between Proton Transport and Morphology of Perfluorosulfonic Acid Membranes: A Reactive Molecular Dynamics Approach

(2018) Takuya Mabuchi et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Comparative study of various cathodes for lithium ion batteries using an enhanced Peukert capacity model

(2018) Ryan O'Malley et al.   JOURNAL OF POWER SOURCES

Optimizing Ion Transport in Polyether-Based Electrolytes for Lithium Batteries

(2018) Qi Zheng et al.   MACROMOLECULES

Effect of Salt Concentration on Ion Clustering and Transport in Polymer Solid Electrolytes: A Molecular Dynamics Study of PEO–LiTFSI

(2018) Nicola Molinari et al.   CHEMISTRY OF MATERIALS

Atomistic Description of Ionic Diffusion in PEO–LiTFSI: Effect of Temperature, Molecular Weight, and Ionic Concentration

(2018) Daniel J. Brooks et al.   MACROMOLECULES

Molecular dynamics study of the effect of wettability of the carbon support on proton transport in Nafion ionomer thin films

(2016) Joji AOCHI et al.   Journal of Thermal Science and Technology

CHARMM36m: an improved force field for folded and intrinsically disordered proteins

(2016) Jing Huang et al.   NATURE METHODS

Molecular Dynamics Simulation of Proton Transport in Polymer Electrolyte Membrane

(2015) Takuya Mabuchi et al.   JOURNAL OF NANOSCIENCE AND NANOTECHNOLOGY

Chemically Specific Dynamic Bond Percolation Model for Ion Transport in Polymer Electrolytes

(2015) Michael A. Webb et al.   MACROMOLECULES

Effect of Molecular Weight and Salt Concentration on Ion Transport and the Transference Number in Polymer Electrolytes

(2015) Ksenia Timachova et al.   MACROMOLECULES

Poly(ethylene oxide)-based electrolytes for lithium-ion batteries

(2015) Zhigang Xue et al.   Journal of Materials Chemistry A

Systematic Computational and Experimental Investigation of Lithium-Ion Transport Mechanisms in Polyester-Based Polymer Electrolytes

(2015) Michael A. Webb et al.   ACS Central Science

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

(2014) Takuya Mabuchi et al.   JOURNAL OF CHEMICAL PHYSICS

Mechanism of ion transport in PEO/LiTFSI complexes: Effect of temperature, molecular weight and end groups

(2012) D. Devaux et al.   SOLID STATE IONICS

Computational Investigation on the Role of Plasticizers on Ion Conductivity in Poly(ethylene oxide) LiTFSI Electrolytes

(2010) Hui Wu et al.   MACROMOLECULES

Understanding the Lithium Transport within a Rouse-Based Model for a PEO/LiTFSI Polymer Electrolyte

(2010) Diddo Diddens et al.   MACROMOLECULES