Gregory R Medders (Gregory Medders)

Publication Activity (10 Years)

Years Active: 2017-2022
Publications (10 Years): 4

Top Topics

Convolutional Neural Network

Density Functional Theory

Energy Transfer

Particulate Matter

Top Venues

The journal of physical chemistry letters

The Journal of chemical physics

The journal of physical chemistry. A

Journal of chemical theory and computation

This page only lists publications with an associated author ORCID identifier.

Publications

Hsing-Ta Chen, Junhan Chen, D Vale Cofer-Shabica, Zeyu Zhou, Vishikh Athavale, Gregory R Medders, Maximilian F S J Menger, Joseph E Subotnik, Zuxin Jin
Methods to Calculate Electronic Excited-State Dynamics for Molecules on Large Metal Clusters with Many States: Ensuring Fast Overlap Calculations and a Robust Choice of Phase. Journal of chemical theory and computation 18 (6) (2022)
Thomas E Gartner Iii, Kelly M Hunter, Eleftherios Lambros, Alessandro Caruso, Marc Riera, Gregory R Medders, Athanassios Z Panagiotopoulos, Pablo G Debenedetti, Francesco Paesani
Anomalies and Local Structure of Liquid Water from Boiling to the Supercooled Regime as Predicted by the Many-Body MB-pol Model. The journal of physical chemistry letters 13 (16) (2022)
Nicole Bellonzi, Gregory R Medders, Evgeny Epifanovsky, Joseph E Subotnik
Configuration interaction singles with spin-orbit coupling: Constructing spin-adiabatic states and their analytical nuclear gradients. The Journal of chemical physics 150 (1) (2019)
Gregory R Medders, Ethan C Alguire, Amber Jain, Joseph E Subotnik
Ultrafast Electronic Relaxation through a Conical Intersection: Nonadiabatic Dynamics Disentangled through an Oscillator Strength-Based Diabatization Framework. The journal of physical chemistry. A 121 (7) (2017)