From c8ce1e0d8ab6d0a090c6feda96c83dde4c4769fd Mon Sep 17 00:00:00 2001
From: "Kurt A. O'Hearn" <ohearnku@msu.edu>
Date: Wed, 12 Dec 2018 15:43:39 -0800
Subject: [PATCH] PuReMD-old: revert debugging code.
---
PuReMD/src/io_tools.c | 17 ++++++++---------
1 file changed, 8 insertions(+), 9 deletions(-)
diff --git a/PuReMD/src/io_tools.c b/PuReMD/src/io_tools.c
index 3de8f824..eaa5503c 100644
--- a/PuReMD/src/io_tools.c
+++ b/PuReMD/src/io_tools.c
@@ -718,21 +718,20 @@ void Print_Sparse_Matrix( reax_system *system, sparse_matrix *A )
void Print_Sparse_Matrix2( reax_system *system, sparse_matrix *A, char *fname )
{
int i, j;
- //FILE *f = fopen( "water_6540_p64_cm.txt", "w" );
+ FILE *f = sfopen( fname, "w", "Print_Sparse_Matrix2" );
if( system->my_rank == 0 )
{
- for ( i = 0; i < A->NT; ++i )
- {
+ for ( i = 0; i < A->n; ++i )
for ( j = A->start[i]; j < A->end[i]; ++j )
- {
- fprintf( stdout, "%d %d %.15e\n",
- i + 1, A->entries[j].j + 1, A->entries[j].val );
- }
- }
+ fprintf( f, "%d %d %.15e\n",
+ system->my_atoms[i].orig_id,
+ system->my_atoms[A->entries[j].j].orig_id,
+ A->entries[j].val );
+
}
- //fclose( f );
+ sfclose( f, "Print_Sparse_Matrix2" );
}
--
GitLab