Revision: | 2384 |
Committed: | Tue Oct 18 21:13:33 2005 UTC (18 years, 11 months ago) by gezelter |
File size: | 327 byte(s) |
Log Message: | added a few GB test cases |
# | User | Rev | Content |
---|---|---|---|
1 | gezelter | 2370 | #ifndef __GB_MD__ |
2 | #define __GB_MD__ | ||
3 | |||
4 | molecule{ | ||
5 | name = "GB"; | ||
6 | nAtoms = 1; | ||
7 | atom[0]{ | ||
8 | gezelter | 2384 | type="GBPaper"; |
9 | gezelter | 2370 | position( 0.0, 0.0, 0.0 ); |
10 | orientation(0.0,0.0,0.0); | ||
11 | } | ||
12 | } | ||
13 | molecule{ | ||
14 | name = "linear"; | ||
15 | nAtoms = 1; | ||
16 | atom[0]{ | ||
17 | type="linear"; | ||
18 | position( 0.0, 0.0, 0.0 ); | ||
19 | orientation(0.0,0.0,0.0); | ||
20 | } | ||
21 | } | ||
22 | #endif |