Madison brings experience working with Professor Makenzie Long to tackling problems in computational chemistry and Andrew brings enthusiasm for all things machine learning to tackle using all of our...
In this manuscript, we develop a novel computational approach for simulating nonlinear optical spectra in the condensed phase. Nonlinear spectroscopy techniques such as 2D electronic spectroscopy...
Welcome! Prachi recieved her Ph.D. in Applied Math at Stony Brook University and will be joining forces with Christine, Karnamohit, and Professor Harish Bhat to use data science and machine learning...
In this study published in PCCP, led by Professor Provorse Long and students at UCA, we demonstrate that the size and flexibility of the first solvation shell of alkaline earth metal ions is key to...
In this paper "The Influence of Electronic Polarization on the Spectral Density," the Isborn and Shi groups have come together to examine the role of polarization by the environment on the low and...
Dr. Shao-Yu Lu was previously with Professor Paul Zimmerman at the University of Michigan and has expertise in quantum computional chemistry, molecular dynamics, and programming. Welcome!
