add support for "error continue" option, which resets the timer timeout setting after a soft exit (1f1c8723) · Commits · 郑智淋 / lammps

src/fix_halt.cpp

+11 −3

Original line number	Diff line number	Diff line
		@@ -109,6 +109,7 @@ int FixHalt::setmask()
		{
		int mask = 0;
		mask \|= END_OF_STEP;
		mask \|= POST_RUN;
		return mask;
		}

		@@ -170,14 +171,21 @@ void FixHalt::end_of_step()
		id,update->ntimestep,attvalue);

		if (eflag == HARD) error->all(FLERR,str);
		else if (eflag == SOFT) {
		else if (eflag == SOFT \|\| eflag == CONTINUE) {
		if (comm->me == 0) error->message(FLERR,str);
		timer->force_timeout();
		} else if (eflag == CONTINUE) {
		// exit this run, but not subsequent ones
		}
		}

		/* ----------------------------------------------------------------------
		reset expired timer setting to original value, if requested
		------------------------------------------------------------------------- */

		void FixHalt::post_run()
		{
		if (eflag == CONTINUE) timer->reset_timeout();
		}

		/* ----------------------------------------------------------------------
		compute max length of any bond using Neighbor bondlist for each proc
		------------------------------------------------------------------------- */

+1 −0

Original line number	Diff line number	Diff line
		@@ -32,6 +32,7 @@ class FixHalt : public Fix {
		int setmask();
		void init();
		void end_of_step();
		void post_run();

		private:
		int attribute,operation,eflag,ivar;