Quantum Dynamics Hub



Overview

This page contains the materials of the workshop entitled "Modular Software Infrastructure for Excited State Dynamics". The workshop was held at the University at Buffalo, June 8-11, 2018 under the umbrella of MolSSI-supported workshops. The workshop discussed the state of the existing methods for dynamics of electronic and electron-nuclear dynamics (ranging from fully quantum approaches to various semi-classical, and quasi-classical metohods). The existing packages and implementations of such methods have been discussed, the range of their potential applicaitons and impact demonstrated, and the future needs identified.

Day 1 (Saturday, June 9, 2018)

Alexey V. Akimov
University at Buffalo, SUNY
Benjamin Pritchard
MolSSI
PDF
Sergei Tretiak
Los Alamos National Laboratory
Qiming Sun
California Institute of Technology
PDF
Alexey V. Akimov
University at Buffalo, SUNY
Victor Batista
Yale University
Eitan Geva
University of Michigan
Nandini Ananth
Cornell University
Sophya Garashchuck
University of South Carolina

Day 2 (Sunday, June 10, 2018)

Oleg Prezhdo
University of Southern California
Artur Izmaylov
University of Toronto, Scarborough
Puja Goyal
Binghamton University, SUNY
Arkajit Mandal
University or Rochester
Lyudmila Slipchenko
Purdue University
Ari Chakraborty
Syracuse University
Michele Pavanello
Rutgers University
PDF
Derrick Yang
McMaster University
PDF

Day 3 (Monday, June 11, 2018)

Michele Pavanello
Rutgets University
Qiming Sun
California Institute of Teachnology