Experimental and theoretical studies of tetramethoxy-p-benzoquinone: infrared spectra, structural and lithium insertion properties

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

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

High-Potential Reversible Li Deintercalation in a Substituted Tetrahydroxy-p-benzoquinone Dilithium Salt: An Experimental and Theoretical Study

(2012) Anne-Lise Barrès et al.   CHEMISTRY-A EUROPEAN JOURNAL

Temperature induced reversible structural and magnetic changes in a crystal of tetrachlorosemiquinone anion radical

(2012) Krešimir Molčanov et al.   CRYSTENGCOMM

The low/room-temperature forms of the lithiated salt of 3,6-dihydroxy-2,5-dimethoxy-p-benzoquinone: a combined experimental and dispersion-corrected density functional study

(2012) Gaëtan Bonnard et al.   CRYSTENGCOMM

Electrochemical properties of crystallized dilithium squarate: insight from dispersion-corrected density functional theory

(2012) Christine Frayret et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Organic Electrode Materials for Rechargeable Lithium Batteries

(2012) Yanliang Liang et al.   Advanced Energy Materials

Rechargeable quasi-solid state lithium battery with organic crystalline cathode

(2012) Yuki Hanyu et al.   Scientific Reports

Stabilisation of tetrabromo- and tetrachlorosemiquinone (bromanil and chloranil) anion radicals in crystals

(2011) Krešimir Molčanov et al.   CRYSTENGCOMM

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

Organic tailored batteries materials using stable open-shell molecules with degenerate frontier orbitals

(2011) Yasushi Morita et al.   NATURE MATERIALS

Application of London-type dispersion corrections to the solid-state density functional theory simulation of the terahertz spectra of crystalline pharmaceuticals

(2011) Matthew D. King et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Evaluation of polyketones with N-cyclic structure as electrode material for electrochemical energy storage: case of pyromellitic diimide dilithium salt

(2010) Stéven Renault et al.   CHEMICAL COMMUNICATIONS

Electrochemical characterization of lithium 4,4′-tolane-dicarboxylate for use as a negative electrode in Li-ion batteries

(2010) Wesley Walker et al.   JOURNAL OF MATERIALS CHEMISTRY

Identifying Doping Strategies To Optimize the Oxide Ion Conductivity in Ceria-Based Materials

(2010) Christine Frayret et al.   Journal of Physical Chemistry C

Ethoxycarbonyl-Based Organic Electrode for Li-Batteries

(2010) Wesley Walker et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

LiMSO4F (M = Fe, Co and Ni): promising new positive electrode materials through the DFT microscope

(2010) Christine Frayret et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Comparative Studies on the Phase Stability, Electronic Structure, and Topology of the Charge Density in the Li3XO4(X = P, As, V) Lithium Orthosalt Polymorphs

(2009) Christine Frayret et al.   CHEMISTRY OF MATERIALS

The Madelung Constant of Organic Salts

(2009) Ekaterina I. Izgorodina et al.   CRYSTAL GROWTH & DESIGN

Electrochemical Reactivity of Lithium Chloranilate vs Li and Crystal Structures of the Hydrated Phases

(2009) Haiyan Chen et al.   ELECTROCHEMICAL AND SOLID STATE LETTERS

Lithium Salt of Tetrahydroxybenzoquinone: Toward the Development of a Sustainable Li-Ion Battery

(2009) Haiyan Chen et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Conjugated dicarboxylate anodes for Li-ion batteries

(2009) M. Armand et al.   NATURE MATERIALS

Accurate Molecular Van Der Waals Interactions from Ground-State Electron Density and Free-Atom Reference Data

(2009) Alexandre Tkatchenko et al.   PHYSICAL REVIEW LETTERS

From Biomass to a Renewable LiXC6O6 Organic Electrode for Sustainable Li-Ion Batteries

(2008) Haiyan Chen et al.   ChemSusChem

A density functional theory study of oxygen diffusion in LaAlO3 and SrTiO3

(2008) M. Lontsi-Fomena et al.   COMPUTATIONAL MATERIALS SCIENCE

Restoring the Density-Gradient Expansion for Exchange in Solids and Surfaces

(2008) John P. Perdew et al.   PHYSICAL REVIEW LETTERS

A Novel Coordination Polymer as Positive Electrode Material for Lithium Ion Battery

(2007) Jiangfeng Xiang et al.   CRYSTAL GROWTH & DESIGN

B3LYP augmented with an empirical dispersion term (B3LYP-D*) as applied to molecular crystals

(2007) Bartolomeo Civalleri et al.   CRYSTENGCOMM