C ------------------------------------------------------------------------------ C Subroutine for the derivative of Jac with respect to rate coefficients C Times a user vector C ----------------------------------------------------------------------------- SUBROUTINE dJac_dRcoeff( V, F, U, NCOEFF, JCOEFF, DJDR ) IMPLICIT NONE INCLUDE 'KPP_ROOT_Parameters.h' INCLUDE 'KPP_ROOT_Sparse.h' C V - Concentrations of variable/radical/fixed species KPP_REAL V(NVAR), F(NFIX) C U - User-supplied Vector KPP_REAL U(NVAR) C NCOEFF - the number of rate coefficients with respect to which we differentiate INTEGER NCOEFF C JCOEFF - a vector of integers containing the indices of reactions (rate C coefficients) with respect to which we differentiate INTEGER JCOEFF(NCOEFF) C DFDR - a matrix containg derivative values; specifically, C column j contains d Jac(1:NVAR) / d RCT( JCOEFF(j) ) * U C for each 1 <= j <= NCOEFF C This matrix is stored in a column-wise linearized format KPP_REAL DJDR(NVAR*NCOEFF) C Local vector for Jacobian of reactant products KPP_REAL JV_RPROD(NJVRP) KPP_REAL aj INTEGER i,j,k C Compute the Jacobian of all reactant products CALL JacReactantProd( V, F, JV_RPROD ) C Compute the derivatives by multiplying column JCOEFF(j) of the stoichiometric matrix with A_PROD DO j=1,NCOEFF C Initialize the j-th column of derivative matrix to zero DO i=1,NVAR DJDR(i+NVAR*(j-1)) = 0.0D0 END DO C Column JCOEFF(j) in the stoichiometric matrix times the C ( Gradient of reactant product of the JCOEFF(j)-th reaction X user vector ) C give the j-th column of the derivative matrix C C Row JCOEFF(j) of JV_RPROD times the user vector aj = 0.d0 DO k=CROW_JVRP(JCOEFF(j)),CROW_JVRP(JCOEFF(j)+1)-1 aj = aj + JV_RPROD(k)*U(ICOL_JVRP(k)) END DO C Column JCOEFF(j) of Stoichiom. matrix times aj DO k=CCOL_STOICM(JCOEFF(j)),CCOL_STOICM(JCOEFF(j)+1)-1 DJDR(IROW_STOICM(k)+NVAR*(j-1)) = STOICM(k)*aj END DO END DO RETURN END