New boron based salts for lithium-ion batteries using conjugated ligands

Benzimidazole-derived anion for lithium-conducting electrolytes

(2016) Leszek Niedzicki et al.   JOURNAL OF POWER SOURCES

Accelerating Electrolyte Discovery for Energy Storage with High-Throughput Screening

(2015) Lei Cheng et al.   Journal of Physical Chemistry Letters

Determination of the electrochemical performance and stability of the lithium-salt, lithium 4,5-dicyano-2-(trifluoromethyl) imidazolide, with various anodes in Li-ion cells

(2015) Sabrina Paillet et al.   JOURNAL OF POWER SOURCES

Advancing a distributed multi-scale computing framework for large-scale high-throughput discovery in materials science

(2015) J Knap et al.   NANOTECHNOLOGY

How to estimate solid-electrolyte-interphase features when screening electrolyte materials

(2015) Tamara Husch et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Electrochemical oxidation stability of anions for modern battery electrolytes: a CBS and DFT study

(2015) Erlendur Jónsson et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Large-scale virtual high-throughput screening for the identification of new battery electrolyte solvents: computing infrastructure and collective properties

(2015) Tamara Husch et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

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

(2015) L. Suo et al.   SCIENCE

An imidazopyrazine-derived anion for lithium conducting electrolyte application

(2015) Leszek Niedzicki et al.   RSC Advances

Large-scale virtual high-throughput screening for the identification of new battery electrolyte solvents: evaluation of electronic structure theory methods

(2014) Martin Korth   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Ab Initio Calculations of Thermal Decomposition Mechanism of LiPF6-Based Electrolytes for Lithium-Ion Batteries

(2013) Yasuharu Okamoto   JOURNAL OF THE ELECTROCHEMICAL SOCIETY

Synthesis and Characterization of Lithium Bis(fluoromalonato)borate for Lithium-Ion Battery Applications

(2013) Chen Liao et al.   Advanced Energy Materials

Initial stages of thermal decomposition of LiPF6-based lithium ion battery electrolytes by detailed Raman and NMR spectroscopy

(2013) Susanne Wilken et al.   RSC Advances

Novel Lithium Imides; Effects of -F, -CF3, and -C≡N Substituents on Lithium Battery Salt Stability and Dissociation

(2012) Johan SCHEERS et al.   ELECTROCHEMISTRY

Modern battery electrolytes: Ion–ion interactions in Li+/Na+ conductors from DFT calculations

(2012) Erlendur Jónsson et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Infrared spectroscopy of instantaneous decomposition products of LiPF6-based lithium battery electrolytes

(2012) Susanne Wilken et al.   SOLID STATE IONICS

The effects of LiBOB additive for stable SEI formation of PP13TFSI-organic mixed electrolyte in lithium ion batteries

(2011) Yongxin An et al.   ELECTROCHIMICA ACTA

Computational Studies of Polysiloxanes: Oxidation Potentials and Decomposition Reactions

(2011) Rajeev S. Assary et al.   Journal of Physical Chemistry C

New covalent salts of the 4+V class for Li batteries

(2011) Leszek Niedzicki et al.   JOURNAL OF POWER SOURCES

The COSMO and COSMO-RS solvation models

(2011) Andreas Klamt   Wiley Interdisciplinary Reviews-Computational Molecular Science

Gas Chromatography/Mass Spectrometry As a Suitable Tool for the Li-Ion Battery Electrolyte Degradation Mechanisms Study

(2010) Grégory Gachot et al.   ANALYTICAL CHEMISTRY

Density functional theory studies on the B-containing lithium salts

(2010) Jiayuan Huang et al.   IONICS

Research progress in high voltage spinel LiNi0.5Mn1.5O4 material

(2010) R. Santhanam et al.   JOURNAL OF POWER SOURCES

Modern generation of polymer electrolytes based on lithium conductive imidazole salts

(2009) L. Niedzicki et al.   JOURNAL OF POWER SOURCES

High-throughput quantum chemistry and virtual screening for lithium ion battery electrolyte additives

(2009) Mathew D. Halls et al.   JOURNAL OF POWER SOURCES

Benzimidazole and imidazole lithium salts for battery electrolytes

(2009) Johan Scheers et al.   JOURNAL OF POWER SOURCES