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CrystalMaker.CrystalDiffract.v1.3.1.Cracked-EAT
CrystalDiffract is designed to make the world of
X-ray (or neutron) powder diffractionintuitive,
interactive, and fun
CrystalDiffract reads from saved crystal files, to
simulate x-ray or neutron powder diffraction
patterns on screen, witheasy manipulation and
measurement tools.
Real-time parameter controls let you experiment with
diffraction and sample settings, with instant
feedback.Combine these with instant mixture
creation – and the ability to load observed data in
the same window – and you have a powerful workbench
application forresearchers, teachers and students
alike.
The New Diffraction
CrystalDiffract goes beyond traditional laboratory
x-ray diffraction, with the ability tosimulate
diffraction from the latest synchrotron x-ray
sources (white-radiation energy-dispersive
diffraction) as well as ultra-high resolution
neutronspallation sources (time-of-flight
diffraction).
Of course, traditional laboratory diffractometer
techniques are also covered, and you present your
resulsas a diffractometer "trace", or a simulated
diffraction film.
Simulating Mixtures
CrystalDiffract can simulate diffraction patterns
frommulti-phase mixtures. You can add new phases to
a mixture simply by dragging and dropping files into
a diffraction window and then clicking theToolbar's
"Mix" button.
You can have virtually unlimited numbers of
components, adjust individual phase proportions in
real time, and turnphases "on" or "off" using
checkboxes in the Structures List. You can toggle
between display of separate diffraction patterns
(perhapsstacked, for greater clarify), and combined
in "mixture mode".
Analyse Experimental Data
CrystalDiffract lets you import multiple
experimental(xy) datasets for comparison with
simulated data: just drag-and-drop text files into
your diffraction window.
You can check your experimental data forimpurity
phases or other anomalies – or even attempt to
identify an unknown phase using a match of observed
and calculated data (the Structures list allowsyou
to quickly scan through a list of ideal phases,
relative to the observed data).
When the observed data have been characterized,
baseline and zero-errorcorrections can be applied
interactively, and a residual graph/film displayed
on screen (together with a sum-of-squares difference
calculation).
PlotControl
CrystalDiffract offers extensive plot control. You
can select a pattern and choose from a wide range of
plot styles. You can specify a precise plotrange,
or search for specific peaks. Scaling controls are
provided for x and y axes, with a Magnify tool and
auto-scaling option. You can also adjustthe
front-to-back ordering of multiple diffraction
patterns, and automatically stack- or collapse the
display.
CrystalDiffract offers high-resolutionprinting,
re-sampling simulated diffraction profiles to match
your printer's resolution. As an alternative to
printing, you can export diffractiontraces as text
files, in xy format, with your chosen x-axis
resolution.
Saving/Exporting Data
CrystalDiffract lets you save your work as a
self-contained"session" file, for quick and
convenient access next time you use the program. You
can also export data files containing structural
data,listings of custom-sorted diffraction data,
structure factors, or diffraction profiles (e.g.,
for plotting in a spreadsheet or graphing program).

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