Experimental and theoretical investigations of dimethylacetamide (DMAc) as electrolyte stabilizing additive for lithium ion batteries

M Xu, L Hao, Y Liu, W Li, L **ng… - The Journal of Physical …, 2011 - ACS Publications
Dimethylacetamide (DMAc) is used as an electrolyte stabilizing additive for lithium ion
battery. The effects of DMAc on the enhancements of electrolyte thermal stability and the …

Theoretical insight into oxidative decomposition of propylene carbonate in the lithium ion battery

L **ng, C Wang, W Li, M Xu, X Meng… - The Journal of Physical …, 2009 - ACS Publications
The detailed oxidative decomposition mechanism of propylene carbonate (PC) in the lithium
ion battery is investigated using density functional theory (DFT) at the level of B3LYP/6 …

A mechanistic Study of the Horner− Wadsworth− Emmons reaction: computational investigation on the reaction pass and the stereochemistry in the reaction of lithium …

K Ando - The Journal of Organic Chemistry, 1999 - ACS Publications
The mechanism of the Horner− Wadsworth− Emmons (HWE) reaction has been investigated
using ab initio calculations (RHF/6-31+ G*). This study revealed that the HWE reaction of the …

Oxidation Decomposition Mechanism of Fluoroethylene Carbonate‐Based Electrolytes for High‐Voltage Lithium Ion Batteries: A DFT Calculation and Experimental …

L **a, B Tang, L Yao, K Wang, A Cheris, Y Pan… - …, 2017 - Wiley Online Library
The oxidative decomposition mechanism of fluoroethylene carbonate (FEC) used in high‐
voltage batteries is investigated by using density functional theory (DFT). Radical cation …

Enediolate–dilithium amide mixed aggregates in the enantioselective alkylation of arylacetic acids: structural studies and a stereochemical model

Y Ma, CE Stivala, AM Wright, T Hayton… - Journal of the …, 2013 - ACS Publications
A combination of X-ray crystallography, 6Li, 15N, and 13C NMR spectroscopies, and density
functional theory computations affords insight into the structures and reactivities of …

Influential role of ethereal solvent on organolithium compounds: The case of carboranyllithium

AR Popescu, AD Musteti… - … A European Journal, 2012 - Wiley Online Library
The influence of ethereal solvents (diethyl ether (Et2O), tetrahydrofuran (THF) or
dimethoxyethane (DME)) on the formation of organolithiated compounds has been studied …

Ring-Opening Polymerization of l-Lactide Initiated by (2-Methacryloxy)ethyloxy−Aluminum Trialkoxides. 1. Kinetics

JL Eguiburu, MJ Fernandez-Berridi, FP Cossio… - …, 1999 - ACS Publications
Kinetic aspects of the synthesis of (2-methacryloxy) ethyloxy functionalized poly (l-lactide)
macromonomers using aluminum mono-and trialkoxides carrying this functionality are …