TY - RPRT TI - First-Principles Calculation of Water p K a Using the Newly Developed SCAN Functional AU - Wang, Ruiyu AU - Carnevale, Vincenzo AU - Klein, Michael L. AU - Borguet, Eric PY - 2019 DO - 10.1021/acs.jpclett.9b02913 UR - https://www.osti.gov/biblio/1608287 ID - 1608287 ER -