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

Comparing trunk/OOPSE/libmdtools/NPTxyz.cpp (file contents):
Revision 855 by mmeineke, Thu Nov 6 22:01:37 2003 UTC vs.
Revision 857 by mmeineke, Fri Nov 7 17:09:48 2003 UTC

#	Line 116 \| Line 116 \| template<typename T> void NPTxyz<T>::evolveEtaB() {
116		}
117		}
118
119	<	template<typename T> void NPTxyz<T>::getVelScaleA(double sc[3], double vel[3]) {
119	>	template<typename T> void NPTxyz<T>::calcVelScale(void) {
120		int i,j;
121	–	double vScale[3][3];
121
122		for (i = 0; i < 3; i++ ) {
123		for (j = 0; j < 3; j++ ) {
#	Line 129 \| Line 128 \| template<typename T> void NPTxyz<T>::getVelScaleA(doub
128		}
129		}
130		}
131	+	}
132
133	+	template<typename T> void NPTxyz<T>::getVelScaleA(double sc[3], double vel[3]) {
134		info->matVecMul3( vScale, vel, sc );
135		}
136
137		template<typename T> void NPTxyz<T>::getVelScaleB(double sc[3], int index ){
138	<	int i,j;
138	>	int j;
139		double myVel[3];
139	–	double vScale[3][3];
140	–
141	–	for (i = 0; i < 3; i++ ) {
142	–	for (j = 0; j < 3; j++ ) {
143	–	vScale[i][j] = eta[i][j];
140
145	–	if (i == j) {
146	–	vScale[i][j] += chi;
147	–	}
148	–	}
149	–	}
150	–
141		for (j = 0; j < 3; j++)
142		myVel[j] = oldVel[3*index + j];
143

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