ICODE-ADC/lammps
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remove dead code, silence compiler warnings

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This commit is contained in:
Axel Kohlmeyer
2021-12-23 01:32:31 -05:00
parent 3dcfc0dfc6
commit 93c7b6928f
3 changed files with 4 additions and 12 deletions
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4
src/MOLECULE/fix_cmap.cpp
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@ -1072,10 +1072,10 @@ void FixCMAP::read_data_header(char *line)
store CMAP interactions as if newton_bond = OFF, even if actually ON store CMAP interactions as if newton_bond = OFF, even if actually ON
------------------------------------------------------------------------- */ ------------------------------------------------------------------------- */
void FixCMAP::read_data_section(char *keyword, int n, char *buf, void FixCMAP::read_data_section(char * /*keyword*/, int /*n*/, char *buf,
tagint id_offset) tagint id_offset)
{ {
int m,tmp,itype; int m,itype;
tagint atom1,atom2,atom3,atom4,atom5; tagint atom1,atom2,atom3,atom4,atom5;
auto lines = utils::split_lines(buf); auto lines = utils::split_lines(buf);

4
src/fix_nve_sphere.cpp
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@ -294,7 +294,6 @@ void FixNVESphere::final_integrate()
// update v,omega for all particles // update v,omega for all particles
// d_omega/dt = torque / inertia // d_omega/dt = torque / inertia
double rke = 0.0;
for (int i = 0; i < nlocal; i++) for (int i = 0; i < nlocal; i++)
if (mask[i] & groupbit) { if (mask[i] & groupbit) {
dtfm = dtf / rmass[i]; dtfm = dtf / rmass[i];
@ -306,8 +305,5 @@ void FixNVESphere::final_integrate()
omega[i][0] += dtirotate * torque[i][0]; omega[i][0] += dtirotate * torque[i][0];
omega[i][1] += dtirotate * torque[i][1]; omega[i][1] += dtirotate * torque[i][1];
omega[i][2] += dtirotate * torque[i][2]; omega[i][2] += dtirotate * torque[i][2];
rke += (omega[i][0]*omega[i][0] + omega[i][1]*omega[i][1] +
omega[i][2]*omega[i][2])*radius[i]*radius[i]*rmass[i];
} }
} }

8
src/min_linesearch.cpp
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@ -328,7 +328,7 @@ int MinLineSearch::linemin_quadratic(double eoriginal, double &alpha)
int i,m,n; int i,m,n;
double fdothall,fdothme,hme,hmax,hmaxall; double fdothall,fdothme,hme,hmax,hmaxall;
double de_ideal,de; double de_ideal,de;
double delfh,engprev,relerr,alphaprev,fhprev,ff,fh,alpha0; double delfh,engprev,relerr,alphaprev,fhprev,fh,alpha0;
double dot[2],dotall[2]; double dot[2],dotall[2];
double *xatom,*x0atom,*fatom,*hatom; double *xatom,*x0atom,*fatom,*hatom;
double alphamax; double alphamax;
@ -439,12 +439,8 @@ int MinLineSearch::linemin_quadratic(double eoriginal, double &alpha)
dotall[1] += fextra[i]*hextra[i]; dotall[1] += fextra[i]*hextra[i];
} }
} }
ff = dotall[0];
fh = dotall[1]; fh = dotall[1];
if (output->thermo->normflag) { if (output->thermo->normflag) fh /= atom->natoms;
ff /= atom->natoms;
fh /= atom->natoms;
}
delfh = fh - fhprev; delfh = fh - fhprev;