[ASAP] Improved Description of a Coordinate Bond in the ReaxFF Reactive Force Field

The Journal of Physical Chemistry LettersDOI: 10.1021/acs.jpclett.9b02668

Source: The Journal of Physical Chemistry Letters - November 12, 2019 Category: Chemistry Authors: Sung Jin Pai, Hong Woo Lee, and Sang Soo Han* Source Type: research