Commit 5914a4c2 authored by Marco Drache's avatar Marco Drache
Browse files

feature: define reaction template Propagation_PnQnp1_changeMonomer

parent b909216e

include/modelObjects.h

+2 −10
Original line number Diff line number Diff line
@@ -48,6 +48,7 @@ enum class ReactionTemplate : uint16_t { 
	Propagation_Macromonomer_HYC,

	Propagation_PnPnp1,

	Propagation_PnQnp1,

	Propagation_PnQnp1_changeMonomer,

	Propagation_SCB,

	RadicalMigration,

	Termination_PnPmDnDm,
@@ -219,16 +220,7 @@ struct reactorPluginDefinition { 
	semibatch semibatchReactorDefinition;

	size_t currentIndexProfiles = 0;

};

struct reactorObject {

	double controlVolume = 0.0;

	double t0controlVolume = 0.0;

	double volume = 1.0;

	double t0Volume = 1.0;

	uint64_t molecules;

	double temperature = -273.15;

	double pressure = 1.0;

	reactorPluginDefinition reactorPlugin;

};



struct MnMw {

	double Mn = 0.0;

	double Mw = 0.0;

src/modelObjects.cpp

+5 −0
Original line number Diff line number Diff line
@@ -75,6 +75,8 @@ std::string ReactionTemplateToString(ReactionTemplate _template) { 
		return "Propagation_PnPnp1";

	case ReactionTemplate::Propagation_PnQnp1:

		return "Propagation_PnQnp1";

	case ReactionTemplate::Propagation_PnQnp1_changeMonomer:

		return "Propagation_PnQnp1_changeMonomer";

	case ReactionTemplate::Propagation_SCB:

		return "Propagation_SCB";

	case ReactionTemplate::RadicalMigration:
@@ -151,6 +153,9 @@ ReactionTemplate StringToReactionTemplate(const std::string& _str) { 
	if (_str == "Propagation_PnQnp1") {

		return ReactionTemplate::Propagation_PnQnp1;

	}

	if (_str == "Propagation_PnQnp1_changeMonomer") {

		return ReactionTemplate::Propagation_PnQnp1_changeMonomer;

	}

	if (_str == "Propagation_SCB") {

		return ReactionTemplate::Propagation_SCB;

	}