diff options
author | Thomas White <taw@bitwiz.org.uk> | 2012-07-30 20:32:55 -0700 |
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committer | Thomas White <taw@bitwiz.org.uk> | 2012-07-30 20:42:51 -0700 |
commit | 0b262aa61f587b69fd46c95841342886580f4946 (patch) | |
tree | 995a2619022ac01e0f96611f47eb37adf195641d /scripts/cif2hkl | |
parent | 31f6c26cd344c01e0c329fa812cf78a7ef9dc700 (diff) |
Update *2hkl scripts, add cif2hkl
Diffstat (limited to 'scripts/cif2hkl')
-rwxr-xr-x | scripts/cif2hkl | 28 |
1 files changed, 28 insertions, 0 deletions
diff --git a/scripts/cif2hkl b/scripts/cif2hkl new file mode 100755 index 00000000..8d82726c --- /dev/null +++ b/scripts/cif2hkl @@ -0,0 +1,28 @@ +#!/usr/bin/perl -w + +use strict; + +my $line; + +printf(" h k l I phase sigma(I) counts" + ." fs/px ss/px\n"); + +while ( $line = <STDIN> ) { + + if ( $line =~ /([\d\-]+)\s+([\d\-]+)\s+([\d\-]+)\so\s+[\d\.\-]+\s+[\d\.\-]+\s+([\d\.\-]+)\s+([\d\.\-]+)\s+$/ ) { + + my $h = $1; + my $k = $2; + my $l = $3; + my $intensity = $4; + my $sigi = $5; + + printf("%3i %3i %3i %10.2f %s %10.2f %7i %6.1f %6.1f\n", + $h, $k, $l, $intensity, " -", $sigi, + 1, 0.0, 0.0); + + } + +} + +printf("End of reflections\n"); |