[ViewVC] Diff of: OpenMD/trunk/src/UseTheForce/DUFF.cpp

Comparing trunk/src/UseTheForce/DUFF.cpp (file contents):
Revision 201 by gezelter, Thu Oct 28 16:56:20 2004 UTC vs.
Revision 202 by gezelter, Thu Nov 4 16:20:28 2004 UTC

#	Line 773 \| Line 773 \| void DUFF::readParams( void ){
773
774		if (currentAtomType->isSSD) {
775		((DirectionalAtomType*)at)->setSticky();
776	–	entry_plug->useSticky = 1;
776		}
777
778		if (currentAtomType->isDipole) {
779		((DirectionalAtomType*)at)->setDipole();
781	–	entry_plug->useDipoles = 1;
780		}
781
782		at->setIdent(currentAtomType->ident);
#	Line 1085 \| Line 1083 \| void DUFF::readParams( void ){
1083		MPIcheckPoint();
1084
1085		#endif // is_mpi
1088	–
1089	–	entry_plug->useLennardJones = 1;
1086		}
1087
1088
#	Line 1145 \| Line 1141 \| void DUFF::initializeAtoms( int nAtoms, Atom the_ato**
1141
1142		the_atoms[i]->setMass( currentAtomType->mass );
1143		the_atoms[i]->setIdent( currentAtomType->ident );
1144	+
1145	+	if (currentAtomType->isSSD) entry_plug->useSticky = 1;
1146	+	if (currentAtomType->isDipole) entry_plug->useDipoles = 1;
1147	+	// Fix this later. We'll set it a bunch of times.
1148	+	entry_plug->useLennardJones = 1;
1149
1150	+
1151		if( bigSigma < currentAtomType->sigma ) bigSigma = currentAtomType->sigma;
1152
1153		if( currentAtomType->isDipole ){

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