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Surface crystallography is a discipline which has come of age.
There exist in the literature several hundred complete
determinations of atomic configurations at surfaces: yet the number
is not so great that cataloguing these structures is too daunting a
task. We felt that now was the right moment to begin a compilation
that could be updated at frequent intervals to give a comprehensive
picture of the known surface world. The following pages are the
product of our labours. Our target community is the large number of
surface chemists, materials scientists, physicists and others whose
work involves surfaces. As the compilation expands with time our
hope is that it will become one of the standard reference works for
structures: in the manner that Wyckoff and other X-ray tables are
for bulk crystals. We have devoted considerable thought to the
format. The system we have chosen will no doubt have its critics,
and in subsequent editions may well be improved, but it has been
arrived at after extensive consultation. A problem that we faced in
putting structures into standard format was the diversity of
conventions used in the literature. It is to be hoped that our
system will have sufficient virtue to serve as a standard format
for future reporting of structures. That would make it much easier
for surface crystallographers to use the work of others.
1. General Description.- 2. Getting Started.- 2.1 Expanding the
Database.- 2.2 Setting up the Program.- 3. The Main Utilities
menu.- 3.1 Selecting Input and Output Files.- 3.2 Defining the
Current Set of Structures.- 3.3 Filing the Current Set of
Structures.- 3.4 Printing a Structure.- 3.5 Listing a Structure.-
4. The Main Editing and Input Menu.- 4.1 Selecting an Old
Structure.- 4.2 Revising a Structure.- 4.3 Filing.- 4.4 Testing for
Inconsistencies.- 5. Using the Graphing Program.- 5.1 First Entry
into the Graphing Routines.- 5.2 Changing the Euler Angles.- 5.3
Changing the Central Atom.- 5.4 Changing the Distance.- 5.5
Magnification.- 5.6 Removing the Atoms.- 5.7 Colour.- 5.8
Perspective.- 5.9 Labeling the Figure.- 5.10 Free Rotation of the
Figure.- 6. Completing the Standard Structure Form.- 6.1 General
Description of the Form.- 6.2 Completion of the Optional Boxes.-
6.3 Completion of the Mandatory Boxes.- 6.4 Filing the Standard
Structure Form.
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