diff options
Diffstat (limited to 'src/partialator.c')
| -rw-r--r-- | src/partialator.c | 5 |
1 files changed, 2 insertions, 3 deletions
diff --git a/src/partialator.c b/src/partialator.c index 10befba8..8cf1dad9 100644 --- a/src/partialator.c +++ b/src/partialator.c @@ -638,7 +638,7 @@ static void write_to_pgraph(FILE *fh, RefList *list, RefList *full, Crystal *cr, { signed int h, k, l; double pobs, pcalc; - double res, corr, Ipart; + double res, Ipart; Reflection *match; if ( !get_flag(refl) ) continue; /* Not free-flagged */ @@ -660,8 +660,7 @@ static void write_to_pgraph(FILE *fh, RefList *list, RefList *full, Crystal *cr, pcalc = get_partiality(refl); /* Observed partiality */ - corr = G * exp(B*res*res) * get_lorentz(refl); - Ipart = get_intensity(refl) * corr; + Ipart = correct_reflection_nopart(refl, G, B, res); pobs = Ipart / get_intensity(match); fprintf(fh, "%5i %4i %4i %4i %e %e %8.3f %8.3f %s\n", |