setup issues with fix numdiff

This commit is contained in:
Steve Plimpton
2020-03-02 13:32:05 -07:00
parent 0e58c1b299
commit 0723bf3db7
3 changed files with 49 additions and 13 deletions

View File

@ -30,6 +30,8 @@ class FixNumDiff : public Fix {
~FixNumDiff();
int setmask();
void init();
void setup(int);
void min_setup(int);
void post_force(int);
void post_force_respa(int, int, int);
void min_post_force(int);
@ -55,6 +57,7 @@ private:
void restore_atoms(int, int);
double update_energy();
void force_clear(double **);
void reallocate();
};
}