Li-diffusion at the interface between Li-metal and [Pyr14][TFSI]-ionic liquid: Ab initio molecular dynamics simulations

Interface Structure in Li-Metal/[Pyr14][TFSI]-Ionic Liquid System from ab Initio Molecular Dynamics Simulations

(2019) Boris V. Merinov et al.   Journal of Physical Chemistry Letters

Effect of electrolyte on the nanostructure of the solid electrolyte interphase (SEI) and performance of lithium metal anodes

(2018) Sunhyung Jurng et al.   Energy & Environmental Science

Understanding transport mechanisms in ionic liquid/carbonate solvent electrolyte blends

(2018) K. Oldiges et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Interfacial reactivity and interphase growth of argyrodite solid electrolytes at lithium metal electrodes

(2018) Sebastian Wenzel et al.   SOLID STATE IONICS

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

(2018) Aiping Wang et al.   npj Computational Materials

Lithium metal stripping beneath the solid electrolyte interphase

(2018) Feifei Shi et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

High-energy-density dual-ion battery for stationary storage of electricity using concentrated potassium fluorosulfonylimide

(2018) Kostiantyn V. Kravchyk et al.   Nature Communications

Decomposition of Ionic Liquids at Lithium Interfaces. 2. Gas Phase Computations

(2017) Justin B. Haskins et al.   Journal of Physical Chemistry C

Lithium Transport in an Amorphous LixSi Anode Investigated by Quasi-elastic Neutron Scattering

(2017) Robert L. Sacci et al.   Journal of Physical Chemistry C

Decomposition of Ionic Liquids at Lithium Interfaces. 1. Ab Initio Molecular Dynamics Simulations

(2017) Handan Yildirim et al.   Journal of Physical Chemistry C

Ion Diffusivity through the Solid Electrolyte Interphase in Lithium-Ion Batteries

(2017) Laura Benitez et al.   JOURNAL OF THE ELECTROCHEMICAL SOCIETY

Review—SEI: Past, Present and Future

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

Quantum Mechanics Reactive Dynamics Study of Solid Li-Electrode/Li6PS5Cl-Electrolyte Interface

(2017) Tao Cheng et al.   ACS Energy Letters

Diffusion Mechanism of Li Argyrodite Solid Electrolytes for Li-Ion Batteries and Prediction of Optimized Halogen Doping: The Effect of Li Vacancies, Halogens, and Halogen Disorder

(2016) Niek J. J. de Klerk et al.   CHEMISTRY OF MATERIALS

Exceptional long-life performance of lithium-ion batteries using ionic liquid-based electrolytes

(2016) Giuseppe Antonio Elia et al.   Energy & Environmental Science

First-principles study of the structural and dynamic properties of the liquid and amorphous Li–Si alloys

(2016) Han-Hsin Chiang et al.   JOURNAL OF CHEMICAL PHYSICS

van der Waals Interactions in Layered Lithium Cobalt Oxides

(2015) Muratahan Aykol et al.   Journal of Physical Chemistry C

In situ methods for Li-ion battery research: A review of recent developments

(2015) P.P.R.M.L. Harks et al.   JOURNAL OF POWER SOURCES

Simulation and Experiment on Solid Electrolyte Interphase (SEI) Morphology Evolution and Lithium-Ion Diffusion

(2015) P. Guan et al.   JOURNAL OF THE ELECTROCHEMICAL SOCIETY

General method to predict voltage-dependent ionic conduction in a solid electrolyte coating on electrodes

(2015) Jie Pan et al.   PHYSICAL REVIEW B

A Review of Solid Electrolyte Interphases on Lithium Metal Anode

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

Lithium Ion Transport and Solvation in N-Butyl-N-methylpyrrolidinium Bis(trifluoromethanesulfonyl)imide–Propylene Carbonate Mixtures

(2014) Ruben-Simon Kühnel et al.   Journal of Physical Chemistry C

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

Analysis of the solid electrolyte interphase formed with an ionic liquid electrolyte for lithium-sulfur batteries

(2014) Shizhao Xiong et al.   JOURNAL OF POWER SOURCES

A thermal-electrochemical model that gives spatial-dependent growth of solid electrolyte interphase in a Li-ion battery

(2014) Lin Liu et al.   JOURNAL OF POWER SOURCES

TOF SIMS characterization of SEI layer on battery electrodes

(2014) I.V. Veryovkin et al.   NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION B-BEAM INTERACTIONS WITH MATERIALS AND ATOMS

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

Role of Specific Cations and Water Entropy on the Stability of Branched DNA Motif Structures

(2012) Tod A. Pascal et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Lithium transport within the solid electrolyte interphase

(2011) Peng Lu et al.   ELECTROCHEMISTRY COMMUNICATIONS

In situ TEM electrochemistry of anode materials in lithium ion batteries

(2011) Xiao Hua Liu et al.   Energy & Environmental Science

Effect of the damping function in dispersion corrected density functional theory

(2011) Stefan Grimme et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Thermodynamics of Water Stabilization of Carboxybetaine Hydrogels from Molecular Dynamics Simulations

(2011) Tod A. Pascal et al.   Journal of Physical Chemistry Letters

Molecular Environment and Enhanced Diffusivity of Li+ Ions in Lithium-Salt-Doped Ionic Liquid Electrolytes

(2011) Franca Castiglione et al.   Journal of Physical Chemistry Letters

Development of ionic liquid-based lithium battery prototypes

(2011) G.-T. Kim et al.   JOURNAL OF POWER SOURCES

LiSICON – ionic liquid electrolyte for lithium ion battery

(2011) Hyea Kim et al.   JOURNAL OF POWER SOURCES

Studies of lithium argyrodite solid electrolytes for all-solid-state batteries

(2011) R. P. Rao et al.   PHYSICA STATUS SOLIDI A-APPLICATIONS AND MATERIALS SCIENCE

Entropy and the driving force for the filling of carbon nanotubes with water

(2011) T. A. Pascal et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Voltammetry in Room Temperature Ionic Liquids: Comparisons and Contrasts with Conventional Electrochemical Solvents.

(2010) L. E. Barrosse-Antle et al.   Chemistry-An Asian Journal

A review of the features and analyses of the solid electrolyte interphase in Li-ion batteries

(2010) Pallavi Verma et al.   ELECTROCHIMICA ACTA

A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu

(2010) Stefan Grimme et al.   JOURNAL OF CHEMICAL PHYSICS

Two-Phase Thermodynamic Model for Efficient and Accurate Absolute Entropy of Water from Molecular Dynamics Simulations

(2010) Shiang-Tai Lin et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Thermodynamics of liquids: standard molar entropies and heat capacities of common solvents from 2PT molecular dynamics

(2010) Tod A. Pascal et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Li-ion anodes in air-stable and hydrophobic ionic liquid-based electrolyte for safer and greener batteries

(2009) Simon F. Lux et al.   INTERNATIONAL JOURNAL OF ENERGY RESEARCH

Ternary polymer electrolytes containing pyrrolidinium-based polymeric ionic liquids for lithium batteries

(2009) G.B. Appetecchi et al.   JOURNAL OF POWER SOURCES

Phenomenologically modeling the formation and evolution of the solid electrolyte interface on the graphite electrode for lithium-ion batteries

(2008) Jian Yan et al.   ELECTROCHIMICA ACTA

Li6PS5X: A Class of Crystalline Li-Rich Solids With an Unusually High Li+ Mobility

(2007) Hans-Jörg Deiseroth et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION