Quantum–continuum simulation of underpotential deposition at electrified metal–solution interfaces

by Stephen E. Weitzner, Ismaila Dabo
Published 2017-01-01

Extensive Benchmarking of DFT+<i>U</i> Calculations for Predicting Band Gaps

by Nicole E. Kirchner-Hall, Wayne Zhao, Yihuang Xiong, Iurii Timrov, Ismaila Dabo
Published 2021-03-01

Tuning Triplet-Pair Separation versus Relaxation Using a Diamond Anvil Cell

by Grayson S. Doucette, Haw-Tyng Huang, Jason M. Munro, Kyle T. Munson, Changyong Park, John E. Anthony, Timothy Strobel, Ismaila Dabo, John V. Badding, John B. Asbury
Published 2020-01-01