Applying Classical, Ab Initio, and Machine-Learning Molecular Dynamics Simulations to the Liquid Electrolyte for Rechargeable Batteries

N Yao, X Chen, ZH Fu, Q Zhang - Chemical Reviews, 2022 - ACS Publications
Rechargeable batteries have become indispensable implements in our daily life and are
considered a promising technology to construct sustainable energy systems in the future …

Strategies to anode protection in lithium metal battery: A review

J Li, Z Kong, X Liu, B Zheng, QH Fan, E Garratt… - InfoMat, 2021 - Wiley Online Library
Lithium metal batteries (LMBs) are considered the most promising energy storage devices
for applications such as electrical vehicles owing to its tremendous theoretical capacity …

The anionic chemistry in regulating the reductive stability of electrolytes for lithium metal batteries

N Yao, SY Sun, X Chen, XQ Zhang, X Shen… - Angewandte …, 2022 - Wiley Online Library
Advanced electrolyte design is essential for building high‐energy‐density lithium (Li)
batteries, and introducing anions into the Li+ solvation sheaths has been widely …

Elementary decomposition mechanisms of lithium hexafluorophosphate in battery electrolytes and interphases

EWC Spotte-Smith, TB Petrocelli, HD Patel… - ACS Energy …, 2022 - ACS Publications
Electrolyte decomposition constitutes an outstanding challenge to long-life Li-ion batteries
(LIBs) as well as emergent energy storage technologies, contributing to protection via solid …

Electrochemical investigation on nickel-doped spinel magnesium ferrite nanoparticles for supercapacitor applications

A Manohar, V Vijayakanth, SVP Vattikuti… - Materials Chemistry and …, 2023 - Elsevier
Due to their extensive cycle life, significant power storage capacity, and quick recharge
ability, electrochemical (EC) capacitors, namely supercapacitors (SCs), have attracted great …

Unusual Size Effect in Ion and Charge Transport in Micron‐Sized Particulate Aluminum Anodes of Lithium‐Ion Batteries

C Jiang, Y Zheng, D Wang, Y Zheng… - Angewandte Chemie …, 2022 - Wiley Online Library
Aluminum is a promising anode material for lithium‐ion batteries owing to its high theoretical
capacity, excellent conductivity, and natural abundance. An anomalous size effect was …

Pathways to next‐generation fire‐safe alkali‐ion batteries

Y Zhang, J Feng, J Qin, YL Zhong, S Zhang… - Advanced …, 2023 - Wiley Online Library
High energy and power density alkali‐ion (ie, Li+, Na+, and K+) batteries (AIBs), especially
lithium‐ion batteries (LIBs), are being ubiquitously used for both large‐and small‐scale …

Direct C(sp3)–H Cyanation Enabled by a Highly Active Decatungstate Photocatalyst

K Kim, S Lee, SH Hong - Organic Letters, 2021 - ACS Publications
A highly efficient, direct C (sp3)–H cyanation was developed under mild photocatalytic
conditions. The method enabled the direct cyanation of various C (sp3)–H substrates with …

Effects of charged interfaces on electrolyte decomposition at the lithium metal anode

LE Camacho-Forero, PB Balbuena - Journal of Power Sources, 2020 - Elsevier
Lithium–Sulfur batteries are promising candidates to substitute conventional Li-ion batteries
due to their higher energy density and reduced cost. However, several challenges related to …

Stability of calcium ion battery electrolytes: predictions from ab initio molecular dynamics simulations

SS Yamijala, H Kwon, J Guo… - ACS Applied Materials & …, 2021 - ACS Publications
Multivalent batteries, such as magnesium-ion, calcium-ion, and zinc-ion batteries, have
attracted significant attention as next-generation electrochemical energy storage devices to …