The Journal of Chemical Physics

147, 121102 (2017)

DOI: 10.1063/1.4997698

This work is about the dreadful things that happen to those (well, basically everyone…) who dare truncating non-bonded terms when performing molecular dynamics simulations of interfaces. It has recently been accepted in The Journal of Physical Chemistry, and involves quite a number of people across several institutions: (chiefly) the University College London [UK], the University of Lyon [France] and Tsinghua University [China]…