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root/group/trunk/langevinHull/PdPt/metals.md
Revision: 3640
Committed: Thu Aug 12 20:25:00 2010 UTC (13 years, 10 months ago) by gezelter
File size: 424 byte(s)
Log Message:
new import of Langevin Hull paper

File Contents

# User Rev Content
1 gezelter 3640 #ifndef __METALS_MD__
2     #define __METALS_MD__
3    
4     molecule{
5     name = "Au";
6    
7     atom[0]{
8     type="Au";
9     position( 0.0, 0.0, 0.0 );
10     }
11     }
12     molecule{
13     name = "Ag";
14    
15     atom[0]{
16     type="Ag";
17     position( 0.0, 0.0, 0.0 );
18     }
19     }
20     molecule{
21     name = "Pt";
22    
23     atom[0]{
24     type="Pt";
25     position( 0.0, 0.0, 0.0 );
26     }
27     }
28     molecule{
29     name = "Pd";
30    
31     atom[0]{
32     type="Pd";
33     position( 0.0, 0.0, 0.0 );
34     }
35     }
36     #endif