#include <lj_cut.h>
Public Member Functions | |
LJCutAtomList (double C6, double C12, double rcut, Array< size_t > atoms1, Array< size_t > atoms2) | |
LJCutAtomList (double C6, double C12, double rcut, Array< size_t > atoms1) |
Pairwise Lennard-Jones potential with smooth cutoff with loops done using atom lists
pele::LJCutAtomList::LJCutAtomList | ( | double | C6, |
double | C12, | ||
double | rcut, | ||
Array< size_t > | atoms1, | ||
Array< size_t > | atoms2 | ||
) | [inline] |
pele::LJCutAtomList::LJCutAtomList | ( | double | C6, |
double | C12, | ||
double | rcut, | ||
Array< size_t > | atoms1 | ||
) | [inline] |