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Publications in Theoretical Chemistry

Mitigating Mechanical Failure of Crystalline Silicon Electrodes for Lithium Batteries by Morphological Design

Physical Chemistry Chemical Physics

Theoretical Chemistry

English

Correction: Convective Heat Transfer in a Measurement Cell for Scanning Electrochemical Microscopy

Physical Chemistry Chemical Physics

Theoretical Chemistry

English

Visible Light Photoexcitation of Pyridine Surface Complex Leading to Selective Dehydrogenative Cross-Coupling With Cyclohexane

Physical Chemistry Chemical Physics

Theoretical Chemistry

English

State- And Conformer-Selected Beams of Aligned and Oriented Molecules for Ultrafast Diffraction Studies

Physical Chemistry Chemical Physics

Theoretical Chemistry

English

On the Feasibility of Reactions Through the Fullerene Wall: A Theoretical Study of NHx@C60

Physical Chemistry Chemical Physics

Theoretical Chemistry

English

Probing the Degradation and Homogeneity of Embedded Perovskite Semiconducting Layers in Photovoltaic Devices by Raman Spectroscopy

Physical Chemistry Chemical Physics

Theoretical Chemistry

English

On the Magnetosensitivity of Lipid Peroxidation: Two- Versus Three-Radical Dynamics

Physical Chemistry Chemical Physics

Theoretical Chemistry

English

A First Principles Study of Fluorescence Quenching in Rhodamine B Dimers: How Can Quenching Occur in Dimeric Species?

Physical Chemistry Chemical Physics

Theoretical Chemistry

English

Positional Recurrence Maps, a Powerful Tool to De-Correlate Static and Dynamical Disorder in Distribution Maps From Molecular Dynamics Simulations: The Case of Nd2NiO4+d

Physical Chemistry Chemical Physics

Theoretical Chemistry

English

Quantum State-Resolved CH4 Dissociation on Pt(111): Coverage Dependent Barrier Heights From Experiment and Density Functional Theory

Physical Chemistry Chemical Physics

Theoretical Chemistry

English

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Discover open access scientific publications

Search, annotate, share and cite publications

Publications in Theoretical Chemistry

Mitigating Mechanical Failure of Crystalline Silicon Electrodes for Lithium Batteries by Morphological Design

Correction: Convective Heat Transfer in a Measurement Cell for Scanning Electrochemical Microscopy

Visible Light Photoexcitation of Pyridine Surface Complex Leading to Selective Dehydrogenative Cross-Coupling With Cyclohexane

State- And Conformer-Selected Beams of Aligned and Oriented Molecules for Ultrafast Diffraction Studies

On the Feasibility of Reactions Through the Fullerene Wall: A Theoretical Study of NHx@C60

Probing the Degradation and Homogeneity of Embedded Perovskite Semiconducting Layers in Photovoltaic Devices by Raman Spectroscopy

On the Magnetosensitivity of Lipid Peroxidation: Two- Versus Three-Radical Dynamics

A First Principles Study of Fluorescence Quenching in Rhodamine B Dimers: How Can Quenching Occur in Dimeric Species?

Positional Recurrence Maps, a Powerful Tool to De-Correlate Static and Dynamical Disorder in Distribution Maps From Molecular Dynamics Simulations: The Case of Nd2NiO4+d

Quantum State-Resolved CH4 Dissociation on Pt(111): Coverage Dependent Barrier Heights From Experiment and Density Functional Theory