Structure Determination by Powder Diffractometry Round Robin

The SDPDRR Homepage is at http://www.cristal.org/SDPDRR/
DATA DOWNLOAD

Data are given in the same order as described in the home page. First line, in .txt files below, contains starting angle, step and final angle in 2-theta degrees ; next lines are given intensities, all in free format.

[Co(NH3)5CO3]NO3.H2O
Data as text files : zhu1.txt (big pref. orient.); zhu2.txt (moderate pref.); zhu3.txt (no (?) pref)
The 3 data files above zipped in zhu.zip

C22H24N2O8HCl
Data as text files : aldxconv.txt ; aldsync.txt
The 2 data files above zipped in ald.zip

Whole data in various format
.txt files (rename as .dat for FULLPROF) in  zhuald.zip or UNIX file tar.gz
.gss files for GSAS, in GSAS.zip or UNIX file tar.gz
.dat files RIT7/LHPM, in RIT7LHPM.zip or UNIX file tar.gz
.xy files, in XY.zip or UNIX file tar.gz
.cpi files, in CPI.zip or UNIX file tar.gz
Bruker/Siemens .uxd and .raw (binary), in siemens.zip or UNIX file tar.gz
---------------------
Unzip the UNIX files by the command :
gzip -d <filename_tar.gz  | tar xvof -
e.g.:
gzip -d <gsas_tar.gz  | tar xvof -

See the patterns
zhu1.gif - zhu2.gif - zhu3.gif - aldxconv.gif - aldsync.gif

Now get the final form as a text file to be sent by e-mail to :
Lachlan M. D. Cranswick
Collaborative Computational Project No 14 (CCP14) for Single Crystal and Powder Diffraction
L.M.D.Cranswick@dl.ac.uk
before June 30, 1998
- Thanks -

Best wishes