Related references
Note: Only part of the references are listed.Perspective-Structure and Stability of the Solid Electrolyte Interphase on Silicon Anodes of Lithium-ion Batteries
Jongjung Kim et al.
JOURNAL OF THE ELECTROCHEMICAL SOCIETY (2021)
Quantum chemical calculations of lithium-ion battery electrolyte and interphase species
Evan Walter Clark Spotte-Smith et al.
SCIENTIFIC DATA (2021)
A chemically consistent graph architecture for massive reaction networks applied to solid-electrolyte interphase formation
Samuel M. Blau et al.
CHEMICAL SCIENCE (2021)
CP2K: An electronic structure and molecular dynamics software package - Quickstep: Efficient and accurate electronic structure calculations
Thomas D. Kuehne et al.
JOURNAL OF CHEMICAL PHYSICS (2020)
Reductive Decomposition of Solvents and Additives toward Solid-Electrolyte Interphase Formation in Lithium-Ion Battery
Yamin Wang et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2020)
Promoting Effect of Si-OH on the Decomposition of Electrolytes in Lithium-Ion Batteries
Yangfan Lin et al.
CHEMISTRY OF MATERIALS (2020)
REACTER: A Heuristic Method for Reactive Molecular Dynamics
Jacob R. Gissinger et al.
MACROMOLECULES (2020)
Atomic thermodynamics and microkinetics of the reduction mechanism of electrolyte additives to facilitate the formation of solid electrolyte interphases in lithium-ion batteries
Xiao Liu et al.
RSC ADVANCES (2020)
The influence of FEC on the solvation structure and reduction reaction of LiPF6/EC electrolytes and its implication for solid electrolyte interphase formation
Tingzheng Hou et al.
NANO ENERGY (2019)
Molecular dynamics investigation of reduced ethylene carbonate aggregation at the onset of solid electrolyte interphase formation
Mathew J. Boyer et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2019)
Generation and Evolution of the Solid Electrolyte Interphase of Lithium-Ion Batteries
Satu Kristiina Heiskanen et al.
JOULE (2019)
Unraveling the Nanoscale Heterogeneity of Solid Electrolyte Interphase Using Tip-Enhanced Raman Spectroscopy
Jagjit Nanda et al.
JOULE (2019)
Ion Solvation and Dynamics at Solid Electrolyte Interphases: A Long Way from Bulk?
Lauren Raguette et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2018)
Buildup of the Solid Electrolyte Interphase on Lithium-Metal Anodes: Reactive Molecular Dynamics Study
Samuel Bertolini et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2018)
Review on modeling of the anode solid electrolyte interphase (SEI) for lithium-ion batteries
Aiping Wang et al.
NPJ COMPUTATIONAL MATERIALS (2018)
Molecular Dynamics of Lithium Ion Transport in a Model Solid Electrolyte Interphase
Ajay Muralidharan et al.
SCIENTIFIC REPORTS (2018)
Structural, Mechanical, and Dynamical Properties of Amorphous Li2CO3 from Molecular Dynamics Simulations
Mahsa Ebrahiminia et al.
CRYSTALS (2018)
Li+ Transport and Mechanical Properties of Model Solid Electrolyte Interphases (SEI): Insight from Atomistic Molecular Dynamics Simulations
Dmitry Bedrov et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2017)
Simulation Protocol for Prediction of a Solid-Electrolyte Interphase on the Silicon-based Anodes of a Lithium-Ion Battery: ReaxFF Reactive Force Field
Kang-Seop Yun et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2017)
Identifying the Structural Basis for the Increased Stability of the Solid Electrolyte Interphase Formed on Silicon with the Additive Fluoroethylene Carbonate
Yanting Jin et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2017)
Insights into the Li Intercalation and SEI Formation on LiSi Nanoclusters
Kie Hankins et al.
JOURNAL OF THE ELECTROCHEMICAL SOCIETY (2017)
Impact of Chemical Follow-up Reactions for Lithium Ion Electrolytes: Generation of Nucleophilic Species, Solid Electrolyte Interphase, and Gas Formation
Stephen E. Burkhardt
JOURNAL OF THE ELECTROCHEMICAL SOCIETY (2017)
Review-SEI: Past, Present and Future
E. Peled et al.
JOURNAL OF THE ELECTROCHEMICAL SOCIETY (2017)
Modeling chemical reactions in classical molecular dynamics simulations
Jacob R. Gissinger et al.
POLYMER (2017)
Reductive Decomposition Reactions of Ethylene Carbonate by Explicit Electron Transfer from Lithium: An eReaxFF Molecular Dynamics Study
Md Mahbubul Islam et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2016)
Lithium-Ion Model Behavior in an Ethylene Carbonate Electrolyte Using Molecular Dynamics
Narendra Kumar et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2016)
Modeling solid-electrolyte interfacial phenomena in silicon anodes
F. A. Soto et al.
CURRENT OPINION IN CHEMICAL ENGINEERING (2016)
Hard X-ray Photoelectron Spectroscopy (HAXPES) Investigation of the Silicon Solid Electrolyte Interphase (SEI) in Lithium-Ion Batteries
Benjamin T. Young et al.
ACS APPLIED MATERIALS & INTERFACES (2015)
Effect of the Electrolyte Composition on SEI Reactions at Si Anodes of Li-Ion Batteries
Julibeth M. Martinez de la Hoz et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2015)
Predicting the voltage dependence of interfacial electrochemical processes at lithium-intercalated graphite edge planes
Kevin Leung
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2015)
Insight into the Solid Electrolyte Interphase on Si Nanowires in Lithium-Ion Battery: Chemical and Morphological Modifications upon Cycling
Catarina Pereira-Nabais et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2014)
On Electrolyte-Dependent Formation of Solid Electrolyte Interphase Film in Lithium-Ion Batteries: Strong Sensitivity to Small Structural Difference of Electrolyte Molecules
Norio Takenaka et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2014)
The formation and stability of the solid electrolyte interface on the graphite anode
Victor A. Agubra et al.
JOURNAL OF POWER SOURCES (2014)
In Situ and Quantitative Characterization of Solid Electrolyte Interphases
Arthur v. Cresce et al.
NANO LETTERS (2014)
3D visualization of inhomogeneous multi-layered structure and Young's modulus of the solid electrolyte interphase (SEI) on silicon anodes for lithium ion batteries
Jieyun Zheng et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2014)
Reduction Reactions of Carbonate Solvents for Lithium Ion Batteries
Daniel M. Seo et al.
ECS ELECTROCHEMISTRY LETTERS (2014)
Reduction Mechanisms of Ethylene Carbonate on Si Anodes of Lithium-Ion Batteries: Effects of Degree of Lithiation and Nature of Exposed Surface
Julibeth M. Martinez de la Hoz et al.
ACS APPLIED MATERIALS & INTERFACES (2013)
Two-electron reduction of ethylene carbonate: A quantum chemistry re-examination of mechanisms
Kevin Leung
CHEMICAL PHYSICS LETTERS (2013)
Atomistic Modeling of the Electrode-Electrolyte Interface in Li-Ion Energy Storage Systems: Electrolyte Structuring
Ryan Jorn et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2013)
Molecular Dynamics Simulations and Experimental Study of Lithium Ion Transport in Dilithium Ethylene Dicarbonate
Oleg Borodin et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2013)
Silicon Solid Electrolyte Interphase (SEI) of Lithium Ion Battery Characterized by Microscopy and Spectroscopy
Mengyun Nie et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2013)
Lithium diffusion in silicon and induced structure disorder: A molecular dynamics study
Huanyu Wang et al.
AIP ADVANCES (2013)
Solid-Electrolyte Interphase Formation and Electrolyte Reduction at Li-Ion Battery Graphite Anodes: Insights from First-Principles Molecular Dynamics
P. Ganesh et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2012)
Effect of electrolytes on the structure and evolution of the solid electrolyte interphase (SEI) in Li-ion batteries: A molecular dynamics study
Sang-Pil Kim et al.
JOURNAL OF POWER SOURCES (2011)
Challenges for Rechargeable Li Batteries
John B. Goodenough et al.
CHEMISTRY OF MATERIALS (2010)
Ab initio molecular dynamics simulations of the initial stages of solid-electrolyte interphase formation on lithium ion battery graphitic anodes
Kevin Leung et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2010)
PACKMOL: A Package for Building Initial Configurations for Molecular Dynamics Simulations
L. Martinez et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2009)
Quantum Chemistry and Molecular Dynamics Simulation Study of Dimethyl Carbonate: Ethylene Carbonate Electrolytes Doped with LiPF6
Oleg Borodin et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2009)
Halide, ammonium, and alkali metal ion parameters for modeling aqueous solutions
Kasper P. Jensen et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2006)
Decomposition reaction of LiPF6-based electrolytes for lithium ion cells
T Kawamura et al.
JOURNAL OF POWER SOURCES (2006)
Lithium ethylene dicarbonate identified as the primary product of chemical and electrochemical reduction of EC in 1.2 m LiPF6/EC:EMC electrolyte
GRV Zhuang et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2005)
Molecular force field for ionic liquids composed of triflate or bistriflylimide anions
JNC Lopes et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2004)
Nonaqueous liquid electrolytes for lithium-based rechargeable batteries
K Xu
CHEMICAL REVIEWS (2004)
Computational study of salt association in Li-ion battery electrolyte
K Tasaki
JOURNAL OF THE ELECTROCHEMICAL SOCIETY (2002)
Theoretical studies to understand surface chemistry on carbon anodes for lithium-ion batteries: Reduction mechanisms of ethylene carbonate
YX Wang et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2001)
Review of selected electrode-solution interactions which determine the performance of Li and Li ion batteries
D Aurbach
JOURNAL OF POWER SOURCES (2000)
Theoretical studies of the reduction of ethylene carbonate
T Li et al.
CHEMICAL PHYSICS LETTERS (2000)
Share Paper
