--- branches/development/src/io/Globals.cpp 2012/05/24 14:23:40 1722 +++ branches/development/src/io/Globals.cpp 2012/05/30 16:08:07 1729 @@ -91,6 +91,7 @@ Globals::Globals() { DefineOptionalParameter(DampingAlpha, "dampingAlpha"); DefineOptionalParameter(SurfaceTension, "surfaceTension"); DefineOptionalParameter(PrintPressureTensor, "printPressureTensor"); + DefineOptionalParameter(PrintHeatFlux, "printHeatFlux"); DefineOptionalParameter(TaggedAtomPair, "taggedAtomPair"); DefineOptionalParameter(PrintTaggedPairDistance, "printTaggedPairDistance"); DefineOptionalParameter(SwitchingFunctionType, "switchingFunctionType"); @@ -143,6 +144,10 @@ Globals::Globals() { DefineOptionalParameterWithDefaultValue(RNEMD_outputTemperature, "RNEMD_outputTemperature", false); DefineOptionalParameterWithDefaultValue(RNEMD_outputVx, "RNEMD_outputVx", false); DefineOptionalParameterWithDefaultValue(RNEMD_outputVy, "RNEMD_outputVy", false); + // James put this in. + DefineOptionalParameterWithDefaultValue(RNEMD_outputDen, "RNEMD_outputDen", false); + DefineOptionalParameterWithDefaultValue(RNEMD_outputAh, "RNEMD_outputAh", false); + DefineOptionalParameterWithDefaultValue(RNEMD_outputVz, "RNEMD_outputVz", false); DefineOptionalParameterWithDefaultValue(RNEMD_outputXyzTemperature, "RNEMD_outputXyzTemperature", false); DefineOptionalParameterWithDefaultValue(RNEMD_outputRotTemperature, "RNEMD_outputRotTemperature", false);