! F12AAF Example Program Text ! Mark 23 Release. NAG Copyright 2011. MODULE f12aafe_mod ! F12AAF Example Program Module: ! Parameters and User-defined Routines ! .. Use Statements .. USE nag_library, ONLY : nag_wp ! .. Implicit None Statement .. IMPLICIT NONE ! .. Parameters .. INTEGER, PARAMETER :: imon = 0, ipoint = 0, nin = 5, & nout = 6 CONTAINS SUBROUTINE tv(nx,x,y) ! Compute the matrix vector multiplication y<---T*x where T is a nx ! by nx tridiagonal matrix with constant diagonals (DD, DL and DU). ! .. Implicit None Statement .. IMPLICIT NONE ! .. Parameters .. REAL (KIND=nag_wp), PARAMETER :: half = 0.5_nag_wp REAL (KIND=nag_wp), PARAMETER :: rho = 100.0_nag_wp ! .. Scalar Arguments .. INTEGER, INTENT (IN) :: nx ! .. Array Arguments .. REAL (KIND=nag_wp), INTENT (IN) :: x(nx) REAL (KIND=nag_wp), INTENT (OUT) :: y(nx) ! .. Local Scalars .. REAL (KIND=nag_wp) :: dd, dl, du, nx1, nx2 INTEGER :: j ! .. Intrinsic Functions .. INTRINSIC real ! .. Executable Statements .. nx1 = real(nx+1,kind=nag_wp) nx2 = nx1*nx1 dd = 4.0_nag_wp*nx2 dl = -nx2 - half*rho*nx1 du = -nx2 + half*rho*nx1 y(1) = dd*x(1) + du*x(2) DO j = 2, nx - 1 y(j) = dl*x(j-1) + dd*x(j) + du*x(j+1) END DO y(nx) = dl*x(nx-1) + dd*x(nx) RETURN END SUBROUTINE tv SUBROUTINE av(nx,v,w) ! .. Use Statements .. USE nag_library, ONLY : daxpy ! .. Implicit None Statement .. IMPLICIT NONE ! .. Scalar Arguments .. INTEGER, INTENT (IN) :: nx ! .. Array Arguments .. REAL (KIND=nag_wp), INTENT (IN) :: v(nx*nx) REAL (KIND=nag_wp), INTENT (OUT) :: w(nx*nx) ! .. Local Scalars .. REAL (KIND=nag_wp) :: nx2 INTEGER :: j, lo ! .. Intrinsic Functions .. INTRINSIC real ! .. Executable Statements .. nx2 = -real((nx+1)*(nx+1),kind=nag_wp) CALL tv(nx,v(1),w(1)) ! The NAG name equivalent of daxpy is f06ecf CALL daxpy(nx,nx2,v(nx+1),1,w(1),1) DO j = 2, nx - 1 lo = (j-1)*nx CALL tv(nx,v(lo+1),w(lo+1)) CALL daxpy(nx,nx2,v(lo-nx+1),1,w(lo+1),1) CALL daxpy(nx,nx2,v(lo+nx+1),1,w(lo+1),1) END DO lo = (nx-1)*nx CALL tv(nx,v(lo+1),w(lo+1)) CALL daxpy(nx,nx2,v(lo-nx+1),1,w(lo+1),1) RETURN END SUBROUTINE av END MODULE f12aafe_mod PROGRAM f12aafe ! F12AAF Example Main Program ! .. Use Statements .. USE nag_library, ONLY : dnrm2, f12aaf, f12abf, f12acf, f12adf, f12aef USE f12aafe_mod, ONLY : av, imon, ipoint, nag_wp, nin, nout ! .. Implicit None Statement .. IMPLICIT NONE ! .. Local Scalars .. REAL (KIND=nag_wp) :: sigmai, sigmar INTEGER :: i, ifail, ifail1, irevcm, lcomm, & ldv, licomm, n, nconv, ncv, nev, & niter, nshift, nx ! .. Local Arrays .. REAL (KIND=nag_wp), ALLOCATABLE :: ax(:), comm(:), d(:,:), mx(:), & resid(:), v(:,:), x(:) INTEGER, ALLOCATABLE :: icomm(:) ! .. Executable Statements .. WRITE (nout,*) 'F12AAF Example Program Results' WRITE (nout,*) ! Skip heading in data file READ (nin,*) READ (nin,*) nx, nev, ncv n = nx*nx ldv = n lcomm = 3*n + 3*ncv*ncv + 6*ncv + 60 licomm = 140 ALLOCATE (ax(n),comm(lcomm),d(ncv,3),mx(n),resid(n),v(ldv,ncv),x(n), & icomm(licomm)) ! ifail: behaviour on error exit ! =0 for hard exit, =1 for quiet-soft, =-1 for noisy-soft ifail = 0 CALL f12aaf(n,nev,ncv,icomm,licomm,comm,lcomm,ifail) ! Set the region of the spectrum that is required. ifail = 0 CALL f12adf('SMALLEST MAG',icomm,comm,ifail) IF (ipoint/=0) THEN ! Use pointers to workspace in calculating matrix vector products ! rather than interfacing through the array X. ifail = 0 CALL f12adf('POINTERS=YES',icomm,comm,ifail) END IF irevcm = 0 ifail = -1 LOOP: DO CALL f12abf(irevcm,resid,v,ldv,x,mx,nshift,comm,icomm,ifail) IF (irevcm/=5) THEN IF (irevcm==-1 .OR. irevcm==1) THEN ! Perform matrix vector multiplication y <--- Op*x IF (ipoint==0) THEN CALL av(nx,x,ax) x(1:n) = ax(1:n) ELSE CALL av(nx,comm(icomm(1)),comm(icomm(2))) END IF ELSE IF (irevcm==4 .AND. imon/=0) THEN ! Set IMON=1 to output monitoring information. CALL f12aef(niter,nconv,d,d(1,2),d(1,3),icomm,comm) ! The NAG name equivalent of dnrm2 is f06ejf WRITE (6,99999) niter, nconv, dnrm2(nev,d(1,3),1) END IF ELSE EXIT LOOP END IF END DO LOOP IF (ifail==0) THEN ! Post-Process using F12ACF to compute eigenvalues and ! (by default) the corresponding eigenvectors. ifail1 = 0 CALL f12acf(nconv,d,d(1,2),v,ldv,sigmar,sigmai,resid,v,ldv,comm, & icomm,ifail1) WRITE (nout,99998) nconv DO i = 1, nconv WRITE (nout,99997) i, d(i,1), d(i,2) END DO END IF 99999 FORMAT (1X,'Iteration',1X,I3,', No. converged =',1X,I3,', norm o', & 'f estimates =',E16.8) 99998 FORMAT (1X/' The ',I4,' Ritz values of smallest magnitude are:'/) 99997 FORMAT (1X,I8,5X,'( ',F12.4,' , ',F12.4,' )') END PROGRAM f12aafe