diff options
| author | Thomas White <taw@physics.org> | 2010-03-20 16:58:27 +0100 |
|---|---|---|
| committer | Thomas White <taw@physics.org> | 2010-03-20 16:58:27 +0100 |
| commit | b2db1f5f8883c4e1b3d527cc034e652f15f0c02e (patch) | |
| tree | fe162d0ca73daa63b040e057fceb67a7aac864c3 /src/reflections.c | |
| parent | 5abe14d1e4c3287df71bb5c13fe3c6846aec017b (diff) | |
get_hkl: Rationalise and make it work properly
Diffstat (limited to 'src/reflections.c')
| -rw-r--r-- | src/reflections.c | 3 |
1 files changed, 1 insertions, 2 deletions
diff --git a/src/reflections.c b/src/reflections.c index 7ab187aa..90f8b116 100644 --- a/src/reflections.c +++ b/src/reflections.c @@ -47,7 +47,6 @@ void write_reflections(const char *filename, unsigned int *counts, fprintf(fh, "angle %5.3f deg\n", rad2deg(gamma)); fprintf(fh, "scale 10\n"); } else { - fprintf(fh, " h k l I sigma(I) 1/d / nm^-1\n"); } @@ -64,9 +63,9 @@ void write_reflections(const char *filename, unsigned int *counts, } else { N = 1; } + if ( zone_axis && (l != 0) ) continue; F = lookup_intensity(ref, h, k, l) / N; - if ( zone_axis && (l != 0) ) continue; if ( cell != NULL ) { s = 2.0*resolution(cell, h, k, l); |