vcs_volPhase update: more members are private
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081f98bdbd
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3df90ebff6
5 changed files with 37 additions and 35 deletions
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@ -946,17 +946,11 @@ namespace VCSnonideal {
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ne++;
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}
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/*
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* Assign and malloc structures
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*/
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VolPhase->nElemConstraints = ne;
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VolPhase->elemResize(ne);
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VolPhase->ElName.resize(ne);
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VolPhase->ElActive.resize(ne+1, 1);
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VolPhase->m_elType.resize(ne, VCS_ELEM_TYPE_ABSPOS);
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if (VolPhase->ChargeNeutralityElement >= 0) {
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VolPhase->m_elType[VolPhase->ChargeNeutralityElement] =
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@ -998,7 +992,7 @@ namespace VCSnonideal {
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string ename = "E";
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VolPhase->ElName[ne] = ename;
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ne++;
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VolPhase->nElemConstraints = ne;
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VolPhase->elemResize(ne);
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}
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}
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@ -36,7 +36,7 @@ namespace VCSnonideal {
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m_singleSpecies(true),
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m_gasPhase(false),
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m_eqnState(VCS_EOS_CONSTANT),
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nElemConstraints(0),
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m_numElemConstraints(0),
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ChargeNeutralityElement(-1),
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m_elemGlobalIndex(0),
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NVolSpecies(0),
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@ -98,7 +98,7 @@ namespace VCSnonideal {
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m_singleSpecies(b.m_singleSpecies),
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m_gasPhase(b.m_gasPhase),
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m_eqnState(b.m_eqnState),
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nElemConstraints(b.nElemConstraints),
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m_numElemConstraints(b.m_numElemConstraints),
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ChargeNeutralityElement(b.ChargeNeutralityElement),
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NVolSpecies(b.NVolSpecies),
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m_totalMolesInert(b.m_totalMolesInert),
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@ -153,20 +153,20 @@ namespace VCSnonideal {
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m_eqnState = b.m_eqnState;
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NVolSpecies = b.NVolSpecies;
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nElemConstraints = b.nElemConstraints;
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m_numElemConstraints = b.m_numElemConstraints;
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ChargeNeutralityElement = b.ChargeNeutralityElement;
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ElName.resize(b.nElemConstraints);
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for (int e = 0; e < b.nElemConstraints; e++) {
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ElName.resize(b.m_numElemConstraints);
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for (int e = 0; e < b.m_numElemConstraints; e++) {
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ElName[e] = b.ElName[e];
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}
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ElActive = b.ElActive;
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m_elType = b.m_elType;
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FormulaMatrix.resize(nElemConstraints, NVolSpecies, 0.0);
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for (int e = 0; e < nElemConstraints; e++) {
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FormulaMatrix.resize(m_numElemConstraints, NVolSpecies, 0.0);
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for (int e = 0; e < m_numElemConstraints; e++) {
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for (int k = 0; k < NVolSpecies; k++) {
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FormulaMatrix[e][k] = b.FormulaMatrix[e][k];
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}
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@ -242,8 +242,10 @@ namespace VCSnonideal {
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}
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/***************************************************************************/
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void vcs_VolPhase::resize(int phaseNum, int nspecies, int numElem, const char *phaseName,
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double molesInert) {
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void vcs_VolPhase::resize(const int phaseNum, const int nspecies,
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const int numElem, const char * const phaseName,
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const double molesInert) {
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#ifdef DEBUG_MODE
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if (nspecies <= 0) {
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plogf("nspecies Error\n");
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std::exit(-1);
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@ -252,7 +254,7 @@ namespace VCSnonideal {
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plogf("phaseNum should be greater than 0\n");
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std::exit(-1);
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}
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#endif
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setTotalMolesInert(molesInert);
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m_phi = 0.0;
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m_phiVarIndex = -1;
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@ -279,7 +281,7 @@ namespace VCSnonideal {
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m_singleSpecies = true;
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}
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if (NVolSpecies == nspecies && numElem == nElemConstraints) {
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if (NVolSpecies == nspecies && numElem == m_numElemConstraints) {
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return;
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}
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@ -289,7 +291,7 @@ namespace VCSnonideal {
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}
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IndSpecies.resize(nspecies,-1);
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IndSpecies.resize(nspecies, -1);
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if ((int) ListSpeciesPtr.size() >= NVolSpecies) {
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for (int i = 0; i < NVolSpecies; i++) {
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@ -336,18 +338,14 @@ namespace VCSnonideal {
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ElName.resize(numElemConstraints);
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ElActive.resize(numElemConstraints, 1);
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ElActive.resize(numElemConstraints+1, 1);
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m_elType.resize(numElemConstraints, VCS_ELEM_TYPE_ABSPOS);
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FormulaMatrix.resize(numElemConstraints, NVolSpecies, 0.0);
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ElName.resize(numElemConstraints, "");
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m_elemGlobalIndex.resize(numElemConstraints, -1);
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nElemConstraints = numElemConstraints;
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m_numElemConstraints = numElemConstraints;
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}
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/***************************************************************************/
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@ -1317,15 +1315,20 @@ namespace VCSnonideal {
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//! Returns the global index of the local element index for the phase
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int vcs_VolPhase::elemGlobalIndex(const int e) const {
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DebugAssertThrowVCS(e >= 0, " vcs_VolPhase::elemGlobalIndex") ;
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DebugAssertThrowVCS(e < nElemConstraints, " vcs_VolPhase::elemGlobalIndex") ;
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DebugAssertThrowVCS(e < m_numElemConstraints, " vcs_VolPhase::elemGlobalIndex") ;
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return m_elemGlobalIndex[e];
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}
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//! Returns the global index of the local element index for the phase
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void vcs_VolPhase::setElemGlobalIndex(const int eLocal, const int eGlobal) {
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DebugAssertThrowVCS(eLocal >= 0, "vcs_VolPhase::setElemGlobalIndex");
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DebugAssertThrowVCS(eLocal < nElemConstraints, "vcs_VolPhase::setElemGlobalIndex");
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DebugAssertThrowVCS(eLocal < m_numElemConstraints, "vcs_VolPhase::setElemGlobalIndex");
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m_elemGlobalIndex[eLocal] = eGlobal;
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}
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int vcs_VolPhase::nElemConstraints() const {
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return m_numElemConstraints;
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}
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}
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@ -143,8 +143,9 @@ namespace VCSnonideal {
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* @param phaseName String name for the phase
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* @param molesInert kmoles of inert in the phase (defaults to zero)
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*/
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void resize(int phaseNum, int numSpecies, int numElem, const char *phaseName,
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double molesInert = 0.0);
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void resize(const int phaseNum, const int numSpecies,
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const int numElem, const char * constphaseName,
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const double molesInert = 0.0);
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void elemResize(const int numElemConstraints);
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@ -477,6 +478,8 @@ namespace VCSnonideal {
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*/
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void setElemGlobalIndex(const int eLocal, const int eGlobal);
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int nElemConstraints() const;
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private:
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//! Evaluate the activity coefficients at the current conditions
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@ -591,12 +594,14 @@ namespace VCSnonideal {
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*/
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int m_eqnState;
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private:
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//! Number of element constraints within the problem
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/*!
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* This is usually equal to the number of elements.
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*/
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int nElemConstraints;
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int m_numElemConstraints;
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public:
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//! This is the element number for the charge neutrality
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//! condition of the phase
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/*!
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@ -237,7 +237,7 @@ namespace VCSnonideal {
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*/
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for (int iph = 0; iph < m_numPhases; iph++) {
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volPhase = m_VolPhaseList[iph];
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for (int e = 0; e < volPhase->nElemConstraints; e++) {
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for (int e = 0; e < volPhase->nElemConstraints(); e++) {
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if (volPhase->elemGlobalIndex(e) == ipos) {
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volPhase->setElemGlobalIndex(e, jpos);
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}
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@ -361,7 +361,7 @@ namespace VCSnonideal {
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void VCS_PROB::addPhaseElements(vcs_VolPhase *volPhase) {
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int e, eVP;
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int foundPos = -1;
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int neVP = volPhase->nElemConstraints;
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int neVP = volPhase->nElemConstraints();
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std::string en;
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std::string enVP;
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/*
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@ -443,7 +443,7 @@ namespace VCSnonideal {
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exit(-1);
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}
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double *const *const fm = volPhase->FormulaMatrix.baseDataAddr();
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for (eVP = 0; eVP < volPhase->nElemConstraints; eVP++) {
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for (eVP = 0; eVP < volPhase->nElemConstraints(); eVP++) {
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e = volPhase->elemGlobalIndex(eVP);
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#ifdef DEBUG_MODE
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if (e < 0) {
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