Affiliated Researchers: Quantum Theory

Affiliates are Penn Staters who have a connection to or an interest in the work of the Institute of Energy and the Environment.

Displaying 9 search result(s) for Quantum Theory.

Stefan Thynell


Professor, Mechanical Engineering
Top research keywords: Thermolysis, Decomposition, Propellants, Radiation, RDX

Abu Asaduzzaman



Top research keywords: Adsorption, Atoms, Density Functional Theory, Electronic Property, Electronic Properties

Kristen Fichthorn


Merrell R. Fenske Professor, Chemical Engineering
Top research keywords: Molecular Dynamics, Simulation, Nanocrystals, Surface, Density Functional Theory

Lorena Tribe


Professor of Chemistry, Division of Science (Berks)
Top research keywords: Computational Chemistry, Glyphosate, Montmorillonite, Sodium Chloride, Chemistry

Nelson Yaw Dzade


Assistant Professor, John and Willie Leone Department of Energy & Mineral Engineering (EME)
Top research keywords: Density Functional Theory, Adsorption, Hydrogen Evolution Reaction, Surface, Nanorods

Shunli Shang


Research Professor, Materials Science and Engineering
Top research keywords: Phonons, Phonon, Thermodynamics, Alloy, Density Functional Theory

Zi-Kui Liu


Professor, Materials Science and Engineering
Top research keywords: Thermodynamics, Alloy, Phonons, Thermodynamic Property, Thermodynamic Properties

Adri van Duin


Professor and Kenneth Kuan-Yuo Kuo Early Career Professorship, Mechanical Engineering
Top research keywords: Molecular Dynamics, Field Theory (physics), Simulation, Force, Computer Simulation

Venkatraman Gopalan


Professor, Materials Science and Engineering
Top research keywords: Ferroelectric Materials, Domain Walls, Lithium Tantalate, Harmonic Generation, Domain Wall