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| author | Thomas White <taw@physics.org> | 2018-03-02 15:13:50 +0100 |
|---|---|---|
| committer | Thomas White <taw@physics.org> | 2018-03-02 15:15:07 +0100 |
| commit | 67988bb782f5e3d54444c7338b203ae3b901595d (patch) | |
| tree | b9167ce77ba357fac0c720eb599458df33f1ca66 /src/post-refinement.c | |
| parent | 06bf0f4ec243686a14c51b48a6ebd19888a49a6f (diff) | |
Don't calculate pobs if reference reflection is weak
Diffstat (limited to 'src/post-refinement.c')
| -rw-r--r-- | src/post-refinement.c | 3 |
1 files changed, 3 insertions, 0 deletions
diff --git a/src/post-refinement.c b/src/post-refinement.c index 007216b9..79ea187a 100644 --- a/src/post-refinement.c +++ b/src/post-refinement.c @@ -617,6 +617,9 @@ void write_specgraph(Crystal *crystal, const RefList *full, match = find_refl(full, h, k, l); if ( match == NULL ) continue; + /* Don't calculate pobs if reference reflection is weak */ + if ( fabs(get_intensity(match)) / get_esd_intensity(match) < 3.0 ) continue; + corr = G * exp(B*res*res) * get_lorentz(refl); Ipart = get_intensity(refl) * corr; Ifull = get_intensity(match); |