[ViewVC] Diff of: group/trunk/mdtools/md

Comparing:
branches/mmeineke/mdtools/md_code/DirectionalAtom.cpp (file contents), Revision 10 by mmeineke, Tue Jul 9 18:40:59 2002 UTC vs.
trunk/mdtools/md_code/DirectionalAtom.cpp (file contents), Revision 184 by mmeineke, Thu Nov 21 20:33:06 2002 UTC

#	Line 2 \| Line 2 \| void DirectionalAtom::setA( double the_A[3][3] ){
2
3		#include "Atom.hpp"
4
5	+	double* Atom::pos; // the position array
6	+	double* Atom::vel; // the velocity array
7	+	double* Atom::frc; // the forc array
8	+	double* Atom::trq; // the torque vector ( space fixed )
9	+
10		void DirectionalAtom::setA( double the_A[3][3] ){
11
12		Axx = the_A[0][0]; Axy = the_A[0][1]; Axz = the_A[0][2];
#	Line 39 \| Line 44 \| void DirectionalAtom::getU( double the_u[3] ){
44		Azz = q0Sqr - q1Sqr -q2Sqr +q3Sqr;
45		}
46
47	+	void DirectionalAtom::getA( double the_A[3][3] ){
48	+
49	+	the_A[0][0] = Axx;
50	+	the_A[0][1] = Axy;
51	+	the_A[0][2] = Axz;
52	+
53	+	the_A[1][0] = Ayx;
54	+	the_A[1][1] = Ayy;
55	+	the_A[1][2] = Ayz;
56	+
57	+	the_A[2][0] = Azx;
58	+	the_A[2][1] = Azy;
59	+	the_A[2][2] = Azz;
60	+	}
61	+
62	+
63		void DirectionalAtom::getU( double the_u[3] ){
64
65		the_u[0] = sux;

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