[ViewVC] Diff of: group/trunk/OOPSE/libmdtools/NVT.cpp

Comparing trunk/OOPSE/libmdtools/NVT.cpp (file contents):
Revision 600 by gezelter, Mon Jul 14 22:38:13 2003 UTC vs.
Revision 645 by tim, Tue Jul 22 19:54:52 2003 UTC

#	Line 11 \| Line 11 \| *NVT::NVT ( SimInfo theInfo, ForceFields* the_ff):**
11
12		// Basic thermostating via Hoover, Phys.Rev.A, 1985, Vol. 31 (5) 1695-1697
13
14	<	NVT::NVT ( SimInfo theInfo, ForceFields the_ff):
15	<	Integrator( theInfo, the_ff )
14	>	template<typename T> NVT<T>::NVT ( SimInfo theInfo, ForceFields the_ff):
15	>	T( theInfo, the_ff )
16		{
17		chi = 0.0;
18		have_tau_thermostat = 0;
19		have_target_temp = 0;
20		}
21
22	<	void NVT::moveA() {
22	>	template<typename T> void NVT<T>::moveA() {
23
24		int i, j;
25		DirectionalAtom* dAtom;
#	Line 102 \| Line 102 \| void NVT::moveB( void ){
102		}
103		}
104
105	<	void NVT::moveB( void ){
105	>	template<typename T> void NVT<T>::moveB( void ){
106		int i, j;
107		DirectionalAtom* dAtom;
108		double Tb[3], ji[3];
#	Line 149 \| Line 149 \| int NVT::readyCheck() {
149		}
150		}
151
152	<	int NVT::readyCheck() {
152	>	template<typename T> int NVT<T>::readyCheck() {
153
154		// First check to see if we have a target temperature.
155		// Not having one is fatal.
#	Line 175 \| Line 175 \| int NVT::readyCheck() {
175		}
176		return 1;
177		}
178	–

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