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Orthorhombic disortion on Li Intercalation in Anatase

Journal article - M Koudriachova, SW de Leeuw, NM Harrison

Effect of Diffusion on Lithium Intercalation in Titanium Dioxide.

Journal article - M Koudriachova, NM Harrison, SW de Leeuw

Open circuit voltage profile for Li-intercalation in rutile and anatase from first principles

Journal article - M Koudriachova, NM Harrison, SW de Leeuw

A First Principles Study of Hydrogen Intercalation in Rutile Structured Titania

Journal article - M Koudriachova, NM Harrison, SW de Leeuw

Comparison of ab initio and empirical approaches to the quartz surface.

Conference paper - M Koudriachova, JVL Beckers, SW de Leeuw

Phase transformation on cation intercalation in anatese from first principle

Abstract - M Koudriachova, NM Harrison, SW de Leeuw

First principle calculation of H- sites in titania

Abstract - M Koudriachova, SW de Leeuw

Influence of doping on the electrochemical properties of anatase TiO2

Journal article - M Koudriachova, NM Harrison, SW de Leeuw

Effect of substitution on Li-intercalation in Anatase

Abstract - M Koudriachova, SW de Leeuw, NM Harrison

Phase Transformations of Anatase TiO2 on Cation Intercalation from First Principles

Journal article - M Koudriachova, NM Harrison, SW de Leeuw

Diffusion of Li-ions in rutile. An ab initio study

Journal article - M Koudriachova, NM Harrison, SW de Leeuw

Phase transformations of anatase TiO2 on cation intercalation from first principles simulation

Conference paper - M Koudriachova, NM Harrison, SW de Leeuw

Hydrogen Intercalation Sites in Rutile Predicted from Ab Inition Calculations

Journal article - M Koudriachova, NM Harrison, SW de Leeuw

Density-functional simulations of lithium intercalation in rutile

Journal article - M Koudriachova, NM Harrison, SW de Leeuw

Lattice-gas model for intercalation compounds.

Journal article - V.I. Kalikmanov, M Koudriachova, SW de Leeuw

Structural Deformations in Lithium Doped Titanium Dioxide

Journal article - M Koudriachova, NM Harrison, SW de Leeuw

First principles predictions for intercalation behaviour

Conference paper - M Koudriachova, NM Harrison, SW de Leeuw

Computer simulation of the quartz surface: a combined ab initio and empirical potential approach.

Journal article - M Koudriachova, JVL Beckers, SW de Leeuw

First principles predictions for intercalation behaviour

Journal article - M Koudriachova, NM Harrison, SW de Leeuw

A new phase of lithiated titania predicted from first priciples

Journal article - M Koudriachova, SW de Leeuw, NM Harrison

M Koudriachova

Authored

Orthorhombic disortion on Li Intercalation in Anatase

Effect of Diffusion on Lithium Intercalation in Titanium Dioxide.

Open circuit voltage profile for Li-intercalation in rutile and anatase from first principles

A First Principles Study of Hydrogen Intercalation in Rutile Structured Titania

Comparison of ab initio and empirical approaches to the quartz surface.

Phase transformation on cation intercalation in anatese from first principle

First principle calculation of H- sites in titania

Influence of doping on the electrochemical properties of anatase TiO2

Effect of substitution on Li-intercalation in Anatase

Phase Transformations of Anatase TiO2 on Cation Intercalation from First Principles

Diffusion of Li-ions in rutile. An ab initio study

Phase transformations of anatase TiO2 on cation intercalation from first principles simulation

Hydrogen Intercalation Sites in Rutile Predicted from Ab Inition Calculations

Density-functional simulations of lithium intercalation in rutile

Lattice-gas model for intercalation compounds.

Structural Deformations in Lithium Doped Titanium Dioxide

First principles predictions for intercalation behaviour

Computer simulation of the quartz surface: a combined ab initio and empirical potential approach.

First principles predictions for intercalation behaviour

A new phase of lithiated titania predicted from first priciples