A density functional theory study on the thermodynamic and dynamic properties of anthraquinone analogue cathode materials for rechargeable lithium ion batteries

First-Principles Density Functional Theory Modeling of Li Binding: Thermodynamics and Redox Properties of Quinone Derivatives for Lithium-Ion Batteries

(2016) Ki Chul Kim et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Playing with isomerism and N substitution in pentalenedione derivatives for organic electrode batteries: how high are the stakes?

(2016) Daniele Tomerini et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

High Energy Organic Cathode for Sodium Rechargeable Batteries

(2015) Haegyeom Kim et al.   CHEMISTRY OF MATERIALS

Study of Lithium Migration Pathways in the Organic Electrode Materials of Li-Battery by Dispersion-Corrected Density Functional Theory

(2015) Yanhui Chen et al.   Journal of Physical Chemistry C

Li-ion battery materials: present and future

(2015) Naoki Nitta et al.   Materials Today

Carbonyls: Powerful Organic Materials for Secondary Batteries

(2015) Bernhard Häupler et al.   Advanced Energy Materials

Binding Energy and Work Function of Organic Electrode Materials Phenanthraquinone, Pyromellitic Dianhydride and Their Derivatives Adsorbed on Graphene

(2014) Yang-Xin Yu   ACS Applied Materials & Interfaces

Rechargeable Lithium–Sulfur Batteries

(2014) Arumugam Manthiram et al.   CHEMICAL REVIEWS

Naphthalene Diimide Based Materials with Adjustable Redox Potentials: Evaluation for Organic Lithium-Ion Batteries

(2014) Geeta S. Vadehra et al.   CHEMISTRY OF MATERIALS

Investigation of the Redox Chemistry of Anthraquinone Derivatives Using Density Functional Theory

(2014) Jonathan E. Bachman et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Theoretical Studies of Carbonyl-Based Organic Molecules for Energy Storage Applications: The Heteroatom and Substituent Effect

(2014) Kenneth Hernández-Burgos et al.   Journal of Physical Chemistry C

Rechargeable organic lithium-ion batteries using electron-deficient benzoquinones as positive-electrode materials with high discharge voltages

(2014) Takato Yokoji et al.   Journal of Materials Chemistry A

A dispersion-corrected DFT study on adsorption of battery active materials anthraquinone and its derivatives on monolayer graphene and h-BN

(2014) Yang-Xin Yu   Journal of Materials Chemistry A

Towards sustainable and versatile energy storage devices: an overview of organic electrode materials

(2013) Zhiping Song et al.   Energy & Environmental Science

Progress in flexible lithium batteries and future prospects

(2013) Guangmin Zhou et al.   Energy & Environmental Science

The Li-Ion Rechargeable Battery: A Perspective

(2013) John B. Goodenough et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Function-oriented design of conjugated carbonyl compound electrodes for high energy lithium batteries

(2013) Yanliang Liang et al.   Chemical Science

Fused Heteroaromatic Organic Compounds for High-Power Electrodes of Rechargeable Lithium Batteries

(2013) Yanliang Liang et al.   Advanced Energy Materials

Powering up the Future: Radical Polymers for Battery Applications

(2012) Tobias Janoschka et al.   ADVANCED MATERIALS

Li-Carboxylate Anode Structure-Property Relationships from Molecular Modeling

(2012) Stephen E. Burkhardt et al.   CHEMISTRY OF MATERIALS

Organic Electrode Materials for Rechargeable Lithium Batteries

(2012) Yanliang Liang et al.   Advanced Energy Materials

Clean energy new deal for a sustainable world: from non-CO2 generating energy sources to greener electrochemical storage devices

(2011) Philippe Poizot et al.   Energy & Environmental Science

A MC/AQ Parasitic Composite as Cathode Material for Lithium Battery

(2011) Zhao Lei et al.   JOURNAL OF THE ELECTROCHEMICAL SOCIETY

Concerted Proton−Electron Transfers: Electrochemical and Related Approaches

(2010) Cyrille Costentin et al.   ACCOUNTS OF CHEMICAL RESEARCH

Thermochemistry of Proton-Coupled Electron Transfer Reagents and its Implications

(2010) Jeffrey J. Warren et al.   CHEMICAL REVIEWS

Theory of Coupled Electron and Proton Transfer Reactions

(2010) Sharon Hammes-Schiffer et al.   CHEMICAL REVIEWS

Theory of Proton-Coupled Electron Transfer in Energy Conversion Processes

(2009) Sharon Hammes-Schiffer   ACCOUNTS OF CHEMICAL RESEARCH

Challenges for Rechargeable Li Batteries†

(2009) John B. Goodenough et al.   CHEMISTRY OF MATERIALS

First principles computational materials design for energy storage materials in lithium ion batteries

(2009) Ying Shirley Meng et al.   Energy & Environmental Science

Universal Solvation Model Based on Solute Electron Density and on a Continuum Model of the Solvent Defined by the Bulk Dielectric Constant and Atomic Surface Tensions

(2009) Aleksandr V. Marenich et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Lithium batteries: Status, prospects and future

(2009) Bruno Scrosati et al.   JOURNAL OF POWER SOURCES

Electrochemical Approach to the Mechanistic Study of Proton-Coupled Electron Transfer

(2008) Cyrille Costentin   CHEMICAL REVIEWS

Building better batteries

(2008) M. Armand et al.   NATURE