A Multi-Stage Ab-initio Quantum Wavepacket Dynamics Formalism for Electronic Structure and Dynamics in Open Systems
Poster, 42nd MidWest Theoretical Chemistry Conference, West Lafayette, IN
Talks and presentations
A Multi-Stage Ab-initio Wavepacket Dynamics Formalism for Electronic Structure and Dynamics in Open Systems.
Talk, Center for Computation and Technology, Louisiana State University, Baton Rouge, LA,
A Multi-Stage Ab-initio Wavepacket Dynamics Formalism for Electron Dynamics in Open Systems.
Talk, 41st MidWest Theoretical Chemistry Conference, Carbondale, IL.
Study of the reactivity of OH radical adducts with isoprene in gas phase and adsorbed on an aerosol using Ab-Initio Molecular Dynamics.
Poster, American Conference on Theoretical Chemistry Conference,, Evanston, IL
Quantum Wavepacket Ab-initio Molecular Dynamics Formalism for Calculating Electron Transport in Molecular Wires
Poster, American Conference on Theoretical Chemistry Conference,, Evanston, IL
Study of the reactivity of OH radical adducts with isoprene in gas phase and adsorbed on an aerosol using Ab-Initio Molecular Dynamics.
Poster, 40th MidWest Theoretical Chemistry Conference, Ann Arbor, MI.
Quantum Wavepacket Ab-initio Molecular Dynamics Formalism for Calculating Electron Transport in Molecular Wires.
Poster, 40th MidWest Theoretical Chemistry Conference, Ann Arbor, MI.
Quantum Wavepacket Ab-initio Molecular Dynamics Formalism for Calculating Electron Transport in Molecular Wires.
Poster, 39th MidWest Theoretical Chemistry Conference, Bloomington, IN.
Dissipative Femtosecond Dynamics of Electronically Excited Systems: A Density Matrix Approach.
Contributed Talk, Amer. Chem. Soc. National Meeting, , Atlanta, GA
Light Emission during Interactions of an Excited Alkali Atom inside or at the surface of a Noble Gas Atom Cluster: A Density Matrix Treatment.
Poster, 46th Sanibel Symposium, St. Simon’s Island, GA.
Calculation of Light Absorption Intensities during Alkali Atom - Noble Gas Atom Interactions from a First Principles Dynamics.
Poster, 45th Sanibel Symposium, St. Simon’s Island, GA.
Time-Propagation of the Quantum-Classical Density Matrix for Electronically Excited Molecular Systems.
Contributed Talk, Amer. Chem. Soc. National Meeting, , Anaheim, CA
Dynamics of Light Emission during Alkali Atom - Rare Gas Atom Interactions: From Atom-Atom Collisions to Interactions in Clusters.
Poster, 44th Sanibel Symposium, St. Augustine, FL.
First Principles Quantum Dynamics of Electronic Excitation and Spin-Orbit Recoupling in Alkali-Noble Gas Atom Interactions.
Poster, 43rd Sanibel Symposium, St. Augustine, FL.
Electronic Excitation and Spin-Orbit Recoupling Cross Sections for Alkali-Atom/Noble Gas-Atom Collisions from a First Principles Quantum Dynamics.
Contributed Talk, Amer. Phys. Soc. DAMOP Meeting, , Boulder, CO
Electronic State-to-State Collision Cross Sections using Transition Integrals.
Poster, 42nd Sanibel Symposium, St. Augustine, FL.