Frontiers in Theoretical Analysis of Solid Electrolyte Interphase Formation Mechanism

Molecular Simulations of the Microstructure Evolution of Solid Electrolyte Interphase during Cyclic Charging/Discharging

(2021) Po-Yu Yang et al.   ACS Applied Materials & Interfaces

Effects of High and Low Salt Concentrations in Electrolytes at Lithium–Metal Anode Surfaces Using DFT-ReaxFF Hybrid Molecular Dynamics Method

(2021) Yue Liu et al.   Journal of Physical Chemistry Letters

Research Development on K-Ion Batteries

(2020) Tomooki Hosaka et al.   CHEMICAL REVIEWS

A cyclic phosphate-based battery electrolyte for high voltage and safe operation

(2020) Qifeng Zheng et al.   Nature Energy

First-Principles Study on the Cation-Dependent Electrochemical Stabilities in Li/Na/K Hydrate-Melt Electrolytes

(2020) Kasumi Miyazaki et al.   ACS Applied Materials & Interfaces

Advances and issues in developing salt-concentrated battery electrolytes

(2019) Yuki Yamada et al.   Nature Energy

Dcdftbmd : Divide-and-Conquer Density Functional Tight-Binding Program for Huge-System Quantum Mechanical Molecular Dynamics Simulations

(2019) Yoshifumi Nishimura et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Microscopic Elucidation of Solid‐electrolyte Interphase (SEI) Film Formation via Atomistic Reaction Simulations: Importance of Functional Groups of Electrolyte and Intact Additive Molecules

(2019) Norio Takenaka et al.   CHEMICAL RECORD

Impact of cis- versus trans-Configuration of Butylene Carbonate Electrolyte on Microscopic Solid Electrolyte Interphase Formation Processes in Lithium-Ion Batteries

(2019) Kasumi Miyazaki et al.   ACS Applied Materials & Interfaces

Reversible Sodium Metal Electrodes: Is Fluorine an Essential Interphasial Component?

(2019) Kyosuke Doi et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Sodium- and potassium-hydrate melts containing asymmetric imide anions for high-voltage aqueous batteries

(2019) Qifeng Zheng et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Lithium-salt monohydrate melt: A stable electrolyte for aqueous lithium-ion batteries

(2019) Seongjae Ko et al.   ELECTROCHEMISTRY COMMUNICATIONS

Microscopic Origin of the Solid Electrolyte Interphase Formation in Fire-Extinguishing Electrolyte: Formation of Pure Inorganic Layer in High Salt Concentration

(2019) Amine Bouibes et al.   Journal of Physical Chemistry Letters

Formation of a Solid Electrolyte Interphase in Hydrate-Melt Electrolytes

(2019) Seongjae Ko et al.   ACS Applied Materials & Interfaces

First-Principles Study on the Peculiar Water Environment in a Hydrate-Melt Electrolyte

(2019) Kasumi Miyazaki et al.   Journal of Physical Chemistry Letters

High-Voltage Lithium-Metal Batteries Enabled by Localized High-Concentration Electrolytes

(2018) Shuru Chen et al.   ADVANCED MATERIALS

Theoretical Analysis of Carrier Ion Diffusion in Superconcentrated Electrolyte Solutions for Sodium-Ion Batteries

(2018) Masaki Okoshi et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Microscopic Formation Mechanism of Solid Electrolyte Interphase Film in Lithium-Ion Batteries with Highly Concentrated Electrolyte

(2018) Norio Takenaka et al.   Journal of Physical Chemistry C

Buildup of the Solid Electrolyte Interphase on Lithium-Metal Anodes: Reactive Molecular Dynamics Study

(2018) Samuel Bertolini et al.   Journal of Physical Chemistry C

Fluoroethylene Carbonate as a Directing Agent in Amorphous Silicon Anodes: Electrolyte Interface Structure Probed by Sum Frequency Vibrational Spectroscopy and Ab Initio Molecular Dynamics

(2018) Yonatan Horowitz et al.   NANO LETTERS

Fluoroethylene Carbonate Induces Ordered Electrolyte Interface on Silicon and Sapphire Surfaces as Revealed by Sum Frequency Generation Vibrational Spectroscopy and X-ray Reflectivity

(2018) Yonatan Horowitz et al.   NANO LETTERS

High-Energy Aqueous Lithium Batteries

(2018) Ali Eftekhari   Advanced Energy Materials

Non-flammable electrolytes with high salt-to-solvent ratios for Li-ion and Li-metal batteries

(2018) Ziqi Zeng et al.   Nature Energy

Materials for lithium-ion battery safety

(2018) Kai Liu et al.   Science Advances

Review on modeling of the anode solid electrolyte interphase (SEI) for lithium-ion batteries

(2018) Aiping Wang et al.   npj Computational Materials

Concentration Effect of Fluoroethylene Carbonate on the Formation of Solid Electrolyte Interphase Layer in Sodium-Ion Batteries

(2018) Amine Bouibes et al.   ACS Applied Materials & Interfaces

Red Moon methodology compatible with quantum mechanics/molecular mechanics framework: Application to solid electrolyte interphase film formation in lithium-ion battery system

(2018) Takuya Fujie et al.   JOURNAL OF CHEMICAL PHYSICS

A Bottom-Up Formation Mechanism of Solid Electrolyte Interphase Revealed by Isotope-Assisted Time-of-Flight Secondary Ion Mass Spectrometry

(2018) Zhe Liu et al.   Journal of Physical Chemistry Letters

In situ quantification of interphasial chemistry in Li-ion battery

(2018) Tongchao Liu et al.   Nature Nanotechnology

A transformation theory of stochastic evolution in Red Moon methodology to time evolution of chemical reaction process in the full atomistic system

(2017) Yuichi Suzuki et al.   JOURNAL OF CHEMICAL PHYSICS

Mesoscale Elucidation of Solid Electrolyte Interphase Layer Formation in Li-Ion Battery Anode

(2017) Feng Hao et al.   Journal of Physical Chemistry C

Review—SEI: Past, Present and Future

(2017) E. Peled et al.   JOURNAL OF THE ELECTROCHEMICAL SOCIETY

“Water-in-Salt” Electrolyte Makes Aqueous Sodium-Ion Battery Safe, Green, and Long-Lasting

(2017) Liumin Suo et al.   Advanced Energy Materials

Fire-extinguishing organic electrolytes for safe batteries

(2017) Jianhui Wang et al.   Nature Energy

Computational Exploration of the Li-Electrode|Electrolyte Interface in the Presence of a Nanometer Thick Solid-Electrolyte Interphase Layer

(2016) Yunsong Li et al.   ACCOUNTS OF CHEMICAL RESEARCH

Advanced High-Voltage Aqueous Lithium-Ion Battery Enabled by “Water-in-Bisalt” Electrolyte

(2016) Liumin Suo et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

The state of understanding of the lithium-ion-battery graphite solid electrolyte interphase (SEI) and its relationship to formation cycling

(2016) Seong Jin An et al.   CARBON

Reductive Decomposition Reactions of Ethylene Carbonate by Explicit Electron Transfer from Lithium: An eReaxFF Molecular Dynamics Study

(2016) Md Mahbubul Islam et al.   Journal of Physical Chemistry C

Decomposition of the fluoroethylene carbonate additive and the glue effect of lithium fluoride products for the solid electrolyte interphase: an ab initio study

(2016) Yukihiro Okuno et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Superconcentrated electrolytes for a high-voltage lithium-ion battery

(2016) Jianhui Wang et al.   Nature Communications

Additive effect of fluoroethylene and difluoroethylene carbonates for the solid electrolyte interphase film formation in sodium-ion batteries: a quantum chemical study

(2016) Uppula Purushotham et al.   RSC Advances

Effect of Hexafluorophosphate and Fluoroethylene Carbonate on Electrochemical Performance and the Surface Layer of Hard Carbon for Sodium-Ion Batteries

(2016) Mouad Dahbi et al.   ChemElectroChem

Modeling solid-electrolyte interfacial phenomena in silicon anodes

(2016) FA Soto et al.   Current Opinion in Chemical Engineering

Hydrate-melt electrolytes for high-energy-density aqueous batteries

(2016) Yuki Yamada et al.   Nature Energy

Formation and Growth Mechanisms of Solid-Electrolyte Interphase Layers in Rechargeable Batteries

(2015) Fernando A. Soto et al.   CHEMISTRY OF MATERIALS

A Computational Chemical Insight into Microscopic Additive Effect on Solid Electrolyte Interphase Film Formation in Sodium-Ion Batteries: Suppression of Unstable Film Growth by Intact Fluoroethylene Carbonate

(2015) Norio Takenaka et al.   Journal of Physical Chemistry C

Li+ Solvation and Ionic Transport in Lithium Solvate Ionic Liquids Diluted by Molecular Solvents

(2015) Kazuhide Ueno et al.   Journal of Physical Chemistry C

Near-Shore Aggregation Mechanism of Electrolyte Decomposition Products to Explain Solid Electrolyte Interphase Formation

(2015) Keisuke Ushirogata et al.   JOURNAL OF THE ELECTROCHEMICAL SOCIETY

Review—Superconcentrated Electrolytes for Lithium Batteries

(2015) Yuki Yamada et al.   JOURNAL OF THE ELECTROCHEMICAL SOCIETY

Enhancing electrochemical intermediate solvation through electrolyte anion selection to increase nonaqueous Li–O2battery capacity

(2015) Colin M. Burke et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

"Water-in-salt" electrolyte enables high-voltage aqueous lithium-ion chemistries

(2015) L. Suo et al.   SCIENCE

High rate and stable cycling of lithium metal anode

(2015) Jiangfeng Qian et al.   Nature Communications

Corrosion Prevention Mechanism of Aluminum Metal in Superconcentrated Electrolytes

(2015) Yuki Yamada et al.   ChemElectroChem

A Review of Solid Electrolyte Interphases on Lithium Metal Anode

(2015) Xin-Bing Cheng et al.   Advanced Science

Controlling SEI Formation on SnSb-Porous Carbon Nanofibers for Improved Na Ion Storage

(2014) Liwen Ji et al.   ADVANCED MATERIALS

Electrolytes and Interphases in Li-Ion Batteries and Beyond

(2014) Kang Xu   CHEMICAL REVIEWS

Research Development on Sodium-Ion Batteries

(2014) Naoaki Yabuuchi et al.   CHEMICAL REVIEWS

On Electrolyte-Dependent Formation of Solid Electrolyte Interphase Film in Lithium-Ion Batteries: Strong Sensitivity to Small Structural Difference of Electrolyte Molecules

(2014) Norio Takenaka et al.   Journal of Physical Chemistry C

Sacrificial Anion Reduction Mechanism for Electrochemical Stability Improvement in Highly Concentrated Li-Salt Electrolyte

(2014) Keitaro Sodeyama et al.   Journal of Physical Chemistry C

Unusual Stability of Acetonitrile-Based Superconcentrated Electrolytes for Fast-Charging Lithium-Ion Batteries

(2014) Yuki Yamada et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Interconnected hollow carbon nanospheres for stable lithium metal anodes

(2014) Guangyuan Zheng et al.   Nature Nanotechnology

A superconcentrated ether electrolyte for fast-charging Li-ion batteries

(2013) Yuki Yamada et al.   CHEMICAL COMMUNICATIONS

A hybrid MC/MD reaction method with rare event-driving mechanism: Atomistic realization of 2-chlorobutane racemization process in DMF solution

(2013) Masataka Nagaoka et al.   CHEMICAL PHYSICS LETTERS

The effects of FEC (fluoroethylene carbonate) electrolyte additive on the lithium storage properties of NiO (nickel oxide) nanocuboids

(2013) Kuok Hau Seng et al.   ENERGY

Role of Solution Structure in Solid Electrolyte Interphase Formation on Graphite with LiPF6 in Propylene Carbonate

(2013) Mengyun Nie et al.   Journal of Physical Chemistry C

Chemistry, Impedance, and Morphology Evolution in Solid Electrolyte Interphase Films during Formation in Lithium Ion Batteries

(2013) Peng Lu et al.   Journal of Physical Chemistry C

A high-rate germanium-particle slurry cast Li-ion anode with high Coulombic efficiency and long cycle life

(2013) Kyle C. Klavetter et al.   JOURNAL OF POWER SOURCES

Diphenyloctyl phosphate as a solid electrolyte interphase forming additive for Li-ion batteries

(2013) In-Jun Park et al.   JOURNAL OF POWER SOURCES

Discharge/charge reaction mechanism of a pyrite-type FeS 2 cathode for sodium secondary batteries

(2013) Ayuko Kitajou et al.   JOURNAL OF POWER SOURCES

Additive Effect on Reductive Decomposition and Binding of Carbonate-Based Solvent toward Solid Electrolyte Interphase Formation in Lithium-Ion Battery

(2013) Keisuke Ushirogata et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Modeling Electrochemical Decomposition of Fluoroethylene Carbonate on Silicon Anode Surfaces in Lithium Ion Batteries

(2013) Kevin Leung et al.   JOURNAL OF THE ELECTROCHEMICAL SOCIETY

Electromechanical Probing of Li/Li2CO3Core/Shell Particles in a TEM

(2013) Bin Xiang et al.   JOURNAL OF THE ELECTROCHEMICAL SOCIETY

Solvate Ionic Liquid Electrolyte for Li–S Batteries

(2013) Kaoru Dokko et al.   JOURNAL OF THE ELECTROCHEMICAL SOCIETY

A new class of Solvent-in-Salt electrolyte for high-energy rechargeable metallic lithium batteries

(2013) Liumin Suo et al.   Nature Communications

Bicontinuous structured silicon anode exhibiting stable cycling performance at elevated temperature

(2013) Myung-Jin Chun et al.   RSC Advances

A novel electrolyte with the ability to form a solid electrolyte interface on the anode and cathode of a LiMn2O4/graphite battery

(2013) Bin Li et al.   Journal of Materials Chemistry A

Sodium-Ion Batteries

(2012) Michael D. Slater et al.   ADVANCED FUNCTIONAL MATERIALS

Micromechanisms of solid electrolyte interphase formation on electrochemically cycled graphite electrodes in lithium-ion cells

(2012) Sandeep Bhattacharya et al.   CARBON

Reactions of Singly-Reduced Ethylene Carbonate in Lithium Battery Electrolytes: A Molecular Dynamics Simulation Study Using the ReaxFF

(2012) Dmitry Bedrov et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Solid–Electrolyte Interphase Formation and Electrolyte Reduction at Li-Ion Battery Graphite Anodes: Insights from First-Principles Molecular Dynamics

(2012) P. Ganesh et al.   Journal of Physical Chemistry C

A review on the key issues for lithium-ion battery management in electric vehicles

(2012) Languang Lu et al.   JOURNAL OF POWER SOURCES

Li Ion Cells Comprising Lithiated Columnar Silicon Film Anodes, TiS2Cathodes and Fluoroethyene Carbonate (FEC) as a Critically Important Component

(2012) Ran Elazari et al.   JOURNAL OF THE ELECTROCHEMICAL SOCIETY

Solvent Oligomerization during SEI Formation on Model Systems for Li-Ion Battery Anodes

(2012) Hadi Tavassol et al.   JOURNAL OF THE ELECTROCHEMICAL SOCIETY

Electrolyte Solvation and Ionic Association

(2012) Daniel M. Seo et al.   JOURNAL OF THE ELECTROCHEMICAL SOCIETY

Fluorinated Ethylene Carbonate as Electrolyte Additive for Rechargeable Na Batteries

(2011) Shinichi Komaba et al.   ACS Applied Materials & Interfaces

Electrochemical Na Insertion and Solid Electrolyte Interphase for Hard-Carbon Electrodes and Application to Na-Ion Batteries

(2011) Shinichi Komaba et al.   ADVANCED FUNCTIONAL MATERIALS

Effect of electrolytes on the structure and evolution of the solid electrolyte interphase (SEI) in Li-ion batteries: A molecular dynamics study

(2011) Sang-Pil Kim et al.   JOURNAL OF POWER SOURCES

Using Atomic Layer Deposition to Hinder Solvent Decomposition in Lithium Ion Batteries: First-Principles Modeling and Experimental Studies

(2011) Kevin Leung et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Kinetic Monte Carlo Simulation of Surface Heterogeneity in Graphite Anodes for Lithium-Ion Batteries: Passive Layer Formation

(2011) Ravi N. Methekar et al.   JOURNAL OF THE ELECTROCHEMICAL SOCIETY

Effect of Fluoroethylene Carbonate (FEC) on the Performance and Surface Chemistry of Si-Nanowire Li-Ion Battery Anodes

(2011) Vinodkumar Etacheri et al.   LANGMUIR

Ab initio molecular dynamics simulations of the initial stages of solid–electrolyte interphase formation on lithium ion battery graphitic anodes

(2010) Kevin Leung et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Whether EC and PC Differ in Interphasial Chemistry on Graphitic Anode and How

(2009) Kang Xu   JOURNAL OF THE ELECTROCHEMICAL SOCIETY

Kinetics of Lithium Ion Transfer at the Interface between Graphite and Liquid Electrolytes: Effects of Solvent and Surface Film

(2009) Yuki Yamada et al.   LANGMUIR

Suppression of dendritic lithium formation by using concentrated electrolyte solutions

(2008) Soon-Ki Jeong et al.   ELECTROCHEMISTRY COMMUNICATIONS