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Publications in Theoretical Chemistry

Thermal Effects on Energetics and Dynamics in Water Cluster Anions (H2O)n−

Journal of Chemical Physics

Theoretical Chemistry

English

Effects of Mg Concentration on Solubility and Chemical State of N in N-Doped MgZnO Alloy

Journal of Chemical Physics

Theoretical Chemistry

English

Localized Orbitals From Basis Sets Augmented With Diffuse Functions

Journal of Chemical Physics

Theoretical Chemistry

English

Demixing, Surface Nematization, and Competing Adsorption in Binary Mixtures of Hard Rods and Hard Spheres Under Confinement

Journal of Chemical Physics

Theoretical Chemistry

English

Detecting Coherent Core-Hole Wave-Packet Dynamics in N2 by Time- And Angle-Resolved Inner-Shell Photoelectron Spectroscopy

Journal of Chemical Physics

Theoretical Chemistry

English

One Pot Microwave Synthesis of Highly Stable AuPd@Pd Supported Core-Shell Nanoparticles

Faraday Discussions

Theoretical Chemistry

English

Non-Photochemical Laser-Induced Nucleation

Journal of Chemical Physics

Theoretical Chemistry

English

Flow Dependence of Interfacial Thermal Resistance in Nanochannels

Journal of Chemical Physics

Theoretical Chemistry

English

Solvent and Conformation Dependence of Amide I Vibrations in Peptides and Proteins Containing Proline

Journal of Chemical Physics

Theoretical Chemistry

English

Multisequence Algorithm for Coarse-Grained Biomolecular Simulations: Exploring the Sequence-Structure Relationship of Proteins

Journal of Chemical Physics

Theoretical Chemistry

English