occ::mults::MoleculeForceResult Struct Reference

Per-site forces for a molecule pair interaction. More...

#include <cartesian_force.h>

Public Attributes
double	energy = 0.0
std::vector< Vec3 >	forces_A
std::vector< Vec3 >	forces_B

Detailed Description

Per-site forces for a molecule pair interaction.

Member Data Documentation

energy

double occ::mults::MoleculeForceResult::energy = 0.0

forces_A

std::vector<Vec3> occ::mults::MoleculeForceResult::forces_A

forces_B

std::vector<Vec3> occ::mults::MoleculeForceResult::forces_B

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The documentation for this struct was generated from the following file:

• /home/runner/work/occ/occ/include/occ/mults/cartesian_force.h