urf2xfit
NAME
urf2xfit - convert an XENGEN urefls file to a vu file for
display in xfit.
USAGE
urf2xfit [urefls] [xfit.vu]
DESCRIPTION
If no files are given, then the program uses stdin and
stdout; if one name is given, then that file is converted to
stdout.
ENVIRONMENT
CRYSTAL is the crystal file. It is used to get the unit cell
for scaling the axes. The present version does not handle
non-orthogonal space-groups correctly but always displays
h,k and l as orthogonal axes. Still, this may be useful.
PURPOSE
By converting a urefls file to a vu file it can be displayed
in three dimensions with xfit. The three axes H,K, and L are
displayed as well as a jack at the position of each reflec-
tion. Data that is missing becomes apparent as well as the
curved nature of Ewald sphere which is often neglected in
data collection strategies. Each run can be turned into a vu
file and displayed in a different color (using the recolor-
ing option in xfit) to see how multiple runs overlap. The
output is colored in 4 bins of intensity from min to max:
blue, cyan, yellow, white. The color scheme needs expanding,
and coloring by phi value would be useful.
VERSION
Release 3.2 of XtalView
SEE ALSO
xtalview(1), xfit(1)