diff options
| author | Thomas White <taw@physics.org> | 2010-06-30 16:27:18 +0200 |
|---|---|---|
| committer | Thomas White <taw@physics.org> | 2012-02-22 15:26:51 +0100 |
| commit | 5bd5b1dbd1a82ab67eb30b0a435c1728ae0905bf (patch) | |
| tree | 78ce895ac0f5c9a02c5e90a79e0a9c2aa04ca333 /src/reflections.c | |
| parent | d4f4991dfd12c8beba670fede3573a9061fbbb37 (diff) | |
Alter format of reflection list, and include number of counts
Diffstat (limited to 'src/reflections.c')
| -rw-r--r-- | src/reflections.c | 11 |
1 files changed, 6 insertions, 5 deletions
diff --git a/src/reflections.c b/src/reflections.c index fdbe86a8..1177c612 100644 --- a/src/reflections.c +++ b/src/reflections.c @@ -50,7 +50,8 @@ void write_reflections(const char *filename, unsigned int *counts, fprintf(fh, "angle %5.3f deg\n", rad2deg(alpha)); fprintf(fh, "scale 10\n"); } else { - fprintf(fh, " h k l I phase(I) sigma(I) 1/d / nm^-1\n"); + fprintf(fh, " h k l I phase sigma(I) " + " 1/d(nm^-1) counts\n"); } for ( h=-INDMAX; h<INDMAX; h++ ) { @@ -73,9 +74,9 @@ void write_reflections(const char *filename, unsigned int *counts, if ( phases != NULL ) { double p; p = lookup_intensity(phases, h, k, l); - snprintf(ph, 31, "%f", p); + snprintf(ph, 31, "%8.6f", p); } else { - strncpy(ph, "-", 31); + strncpy(ph, " -", 31); } if ( cell != NULL ) { @@ -85,8 +86,8 @@ void write_reflections(const char *filename, unsigned int *counts, } /* h, k, l, I, sigma(I), s */ - fprintf(fh, "%3i %3i %3i %10.2f %s %10.2f %10.2f\n", - h, k, l, intensity, ph, 0.0, s/1.0e9); + fprintf(fh, "%3i %3i %3i %10.2f %s %10.2f %10.2f %7i\n", + h, k, l, intensity, ph, 0.0, s/1.0e9, N); } } |