#include <gamessplugin.h>
Public Attributes | |
| char | type [8] |
| float | charge |
| float | x |
| float | y |
| float | z |
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Definition at line 270 of file gamessplugin.h. Referenced by get_initial_info, and read_gamess_structure. |
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Definition at line 268 of file gamessplugin.h. Referenced by get_initial_info, and read_gamess_structure. |
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Definition at line 272 of file gamessplugin.h. Referenced by get_initial_info, get_system_dimensions, and read_next_timestep. |
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Definition at line 272 of file gamessplugin.h. Referenced by get_initial_info, get_system_dimensions, and read_next_timestep. |
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Definition at line 272 of file gamessplugin.h. Referenced by get_initial_info, get_system_dimensions, and read_next_timestep. |
1.2.14 written by Dimitri van Heesch,
© 1997-2002