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Publications in Theoretical Chemistry

Glass-Like Stress Relaxation of a Permanent Gelatin Network as a Signature of Pretransitional Helix-Coil Fluctuations

Journal of Chemical Physics

Theoretical Chemistry

English

A Polarizable Continuum Model for Molecules at Spherical Diffuse Interfaces

Journal of Chemical Physics

Theoretical Chemistry

English

Quantum-Classical Calculations of X-Ray Photoelectron Spectra of Polymers—Polymethyl Methacrylate Revisited

Journal of Chemical Physics

Theoretical Chemistry

English

Photoinduced Hole Transfer From Tris(bipyridine)ruthenium Dye to a High-Valent Iron-Based Water Oxidation Catalyst

Faraday Discussions

Theoretical Chemistry

English

Lowest Triplet (N,π*) State of 2-Cyclohexen-1-One: Characterization by Cavity Ringdown Spectroscopy and Quantum-Chemical Calculations

Journal of Chemical Physics

Theoretical Chemistry

English

Communication: A Difference Density Picture for the Self-Consistent Field Ansatz

Journal of Chemical Physics

Theoretical Chemistry

English

Study of the Isotropic to Smectic-A Phase Transition in Liquid Crystal and Acetone Binary Mixtures

Journal of Chemical Physics

Theoretical Chemistry

English

X-Ray Raman Scattering Provides Evidence for Interfacial Acetonitrile-Water Dipole Interactions in Aqueous Solutions

Journal of Chemical Physics

Theoretical Chemistry

English

Communication: Classical Threshold Law for Ion-Neutral-Neutral Three-Body Recombination

Journal of Chemical Physics

Theoretical Chemistry

English

The Search for the Hydrophobic Force Law

Faraday Discussions

Theoretical Chemistry

English