Joel's paper in J. Chem. Theory Comp. examines the size of QM region necessary for computing converged aqueous absorption spectra for solutes of varying polarity. We used large QM solvation regions...
Makenzie will be starting her independent career this fall as a tenure-track Assistant Professor at The University of Central Arkansas! Congrats Makenzie!
Jessica Maat (REU student with us during summer 2016 through the AIMM program) has been accepted to the ACS undergraduate computational workshop to be held at the April ACS meeting in San Francisco...
Makenzie's paper (with undergrad Thomas Peev and high school student Chou Xiong) is accepted in J. Phys. Chem. B. This paper describes how to mix explicit quantum solvent with classical continuum and...