remove some dead code and reduce compiler warnings in SNAP package (4e5520ce) · Commits · 郑智淋 / lammps

src/SNAP/pair_snap.cpp

+3 −3

Changes for src/SNAP/pair_snap.cpp: 3 added lines, 3 removed lines.
Original line number	Diff line number	Diff line
		@@ -273,7 +273,7 @@ void PairSNAP::compute_bispectrum()
		{
		int i,j,jnum,ninside;
		double delx,dely,delz,rsq;
		int jlist,numneigh,**firstneigh;
		int *jlist;

		double **x = atom->x;
		int *type = atom->type;
		@@ -350,9 +350,9 @@ void PairSNAP::allocate()
		global settings
		------------------------------------------------------------------------- */

		void PairSNAP::settings(int narg, char **arg)
		void PairSNAP::settings(int narg, char ** /* arg */)
		{
		for (int i=0; i < narg; i++)
		if (narg > 0)
		error->all(FLERR,"Illegal pair_style command");
		}

src/SNAP/sna.cpp

+0 −14

Changes for src/SNAP/sna.cpp: 0 added lines, 14 removed lines.
Original line number	Diff line number	Diff line
		@@ -350,7 +350,6 @@ void SNA::compute_ui(int jnum)
		void SNA::compute_zi()
		{

		int ma2, mb2;
		for(int jjz = 0; jjz < idxz_max; jjz++) {
		const int j1 = idxz[jjz].j1;
		const int j2 = idxz[jjz].j2;
		@@ -407,8 +406,6 @@ void SNA::compute_zi()

		void SNA::compute_yi(const double* beta)
		{
		int j;
		int jjz;
		int jju;
		double betaj;

		@@ -422,7 +419,6 @@ void SNA::compute_yi(const double* beta)
		} // end loop over ma, mb
		} // end loop over j

		int ma2, mb2;
		for(int jjz = 0; jjz < idxz_max; jjz++) {
		const int j1 = idxz[jjz].j1;
		const int j2 = idxz[jjz].j2;
		@@ -435,8 +431,6 @@ void SNA::compute_yi(const double* beta)
		const int nb = idxz[jjz].nb;

		const double* cgblock = cglist + idxcg_block[j1][j2][j];
		int mb = (2 * (mb1min+mb2max) - j1 - j2 + j) / 2;
		int ma = (2 * (ma1min+ma2max) - j1 - j2 + j) / 2;

		double ztmp_r = 0.0;
		double ztmp_i = 0.0;
		@@ -549,7 +543,6 @@ void SNA::compute_deidrj(double* dedr)
		jju++;
		}

		int ma = mb;
		double* dudr_r = dulist_r[jju];
		double* dudr_i = dulist_i[jju];
		double jjjmambyarray_r = ylist_r[jju];
		@@ -658,10 +651,6 @@ void SNA::compute_dbidrj()
		double* dbdr;
		double* dudr_r, *dudr_i;
		double sumzdu_r[3];
		double** jjjzarray_r;
		double** jjjzarray_i;
		double jjjmambzarray_r;
		double jjjmambzarray_i;
		int jjz, jju;

		for(int jjb = 0; jjb < idxb_max; jjb++) {
		@@ -708,7 +697,6 @@ void SNA::compute_dbidrj()
		jjz++;
		jju++;
		}
		int ma = mb;
		dudr_r = dulist_r[jju];
		dudr_i = dulist_i[jju];
		for(int k = 0; k < 3; k++)
		@@ -758,7 +746,6 @@ void SNA::compute_dbidrj()
		jjz++;
		jju++;
		}
		int ma = mb;
		dudr_r = dulist_r[jju];
		dudr_i = dulist_i[jju];
		for(int k = 0; k < 3; k++)
		@@ -808,7 +795,6 @@ void SNA::compute_dbidrj()
		jjz++;
		jju++;
		}
		int ma = mb;
		dudr_r = dulist_r[jju];
		dudr_i = dulist_i[jju];
		for(int k = 0; k < 3; k++)

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