|
n2p2 - A neural network potential package
|
#include <mpi.h>#include <string.h>#include "pair_hdnnp_develop.h"#include "atom.h"#include "domain.h"#include "comm.h"#include "neighbor.h"#include "neigh_list.h"#include "neigh_request.h"#include "memory.h"#include "error.h"#include "force.h"#include "update.h"#include "utils.h"#include <stdexcept>#include <iostream>#include "InterfaceLammps.h"