TY - RPRT TI - Modeling bicarbonate formation in an alkaline solution with multi-level quantum mechanics/molecular dynamics simulations AU - Bobell, Benjamin AU - Boyn, Jan-Niklas AU - Martirez, John P. AU - Carter, Emily A. PY - 2024 DO - 10.1080/00268976.2024.2375370 UR - https://www.osti.gov/biblio/2426349 ID - 2426349 ER -