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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4188 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp
2010-05-21 20:05:47 +00:00
parent 278d6cb95c
commit 7a5cf1480a
7 changed files with 94 additions and 94 deletions
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6
src/min.cpp
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@ -640,7 +640,7 @@ double Min::fnorm_sqr()
double *fatom;
double local_norm2_sqr = 0.0;
for (i = 0; i < n3; i++) local_norm2_sqr += f[i]*f[i];
for (i = 0; i < nvec; i++) local_norm2_sqr += fvec[i]*fvec[i];
if (nextra_atom) {
for (int m = 0; m < nextra_atom; m++) {
fatom = fextra_atom[m];
@ -670,8 +670,8 @@ double Min::fnorm_inf()
double *fatom;
double local_norm_inf = 0.0;
for (i = 0; i < n3; i++)
local_norm_inf = MAX(fabs(f[i]),local_norm_inf);
for (i = 0; i < nvec; i++)
local_norm_inf = MAX(fabs(fvec[i]),local_norm_inf);
if (nextra_atom) {
for (int m = 0; m < nextra_atom; m++) {
fatom = fextra_atom[m];