NAG Library Routine Document

F12AQF

1  Purpose

2  Specification

3  Description

4  References

5  Parameters

1:     $\mathrm{NCONV}$ – INTEGEROutput

On exit: the number of converged eigenvalues as found by F12ARF.

2:     $\mathrm{D}\left(*\right)$ – COMPLEX (KIND=nag_wp) arrayOutput

Note: the dimension of the array D must be at least $\mathbf{NCV}$ (see F12ANF).

On exit: the first NCONV locations of the array D contain the converged approximate eigenvalues.

3:     $\mathrm{Z}\left(\mathbf{LDZ},*\right)$ – COMPLEX (KIND=nag_wp) arrayOutput

Note: the second dimension of the array Z must be at least $\mathbf{NEV}$ if the default option $\mathbf{Vectors}=\mathrm{RITZ}$ has been selected and at least $1$ if the option $\mathbf{Vectors}=\mathrm{NONE}$ or $\mathrm{SCHUR}$ has been selected (see F12ANF).

On exit: if the default option $\mathbf{Vectors}=\mathrm{RITZ}$ (see F12ADF) has been selected then Z contains the final set of eigenvectors corresponding to the eigenvalues held in D. The complex eigenvector associated with an eigenvalue is stored in the corresponding column of Z.

4:     $\mathrm{LDZ}$ – INTEGERInput

On entry: the first dimension of the array Z as declared in the (sub)program from which F12AQF is called.

Constraints:

• if the default option $\mathbf{Vectors}=\text{Ritz}$ has been selected, $\mathbf{LDZ}\ge \mathbf{N}$;
• if the option $\mathbf{Vectors}=\text{None or Schur}$ has been selected, $\mathbf{LDZ}\ge 1$.

5:     $\mathrm{SIGMA}$ – COMPLEX (KIND=nag_wp)Input

On entry: if one of the Shifted Inverse (see F12ARF) modes has been selected then SIGMA contains the shift used; otherwise SIGMA is not referenced.

6:     $\mathrm{RESID}\left(*\right)$ – COMPLEX (KIND=nag_wp) arrayInput

Note: the dimension of the array RESID must be at least $\mathbf{N}$ (see F12ANF).

On entry: must not be modified following a call to F12APF since it contains data required by F12AQF.

7:     $\mathrm{V}\left(\mathbf{LDV},*\right)$ – COMPLEX (KIND=nag_wp) arrayInput/Output

Note: the second dimension of the array V must be at least $\max \left(1,\mathbf{NCV}\right)$ (see F12ANF).

On entry: the NCV columns of V contain the Arnoldi basis vectors for $\mathrm{OP}$ as constructed by F12APF.

On exit: if the option $\mathbf{Vectors}=\mathrm{SCHUR}$ or $\mathrm{RITZ}$ has been set and a separate array Z has been passed (i.e., Z does not equal V), then the first NCONV columns of V will contain approximate Schur vectors that span the desired invariant subspace.

8:     $\mathrm{LDV}$ – INTEGERInput

On entry: the first dimension of the array V as declared in the (sub)program from which F12AQF is called.

Constraint: $\mathbf{LDV}\ge \mathbf{N}$.

9:     $\mathrm{COMM}\left(*\right)$ – COMPLEX (KIND=nag_wp) arrayCommunication Array

Note: the dimension of the array COMM must be at least $\max \left(1,\mathbf{LCOMM}\right)$ (see F12ANF).

On initial entry: must remain unchanged from the prior call to F12ANF.

On exit: contains data on the current state of the solution.

10:   $\mathrm{ICOMM}\left(*\right)$ – INTEGER arrayCommunication Array

Note: the dimension of the array ICOMM must be at least $\max \left(1,\mathbf{LICOMM}\right)$ (see F12ANF).

On initial entry: must remain unchanged from the prior call to F12ANF.

On exit: contains data on the current state of the solution.

11:   $\mathrm{IFAIL}$ – INTEGERInput/Output

On entry: IFAIL must be set to $0$, $-1\text{ or }1$. If you are unfamiliar with this parameter you should refer to Section 3.3 in the Essential Introduction for details.

For environments where it might be inappropriate to halt program execution when an error is detected, the value $-1\text{ or }1$ is recommended. If the output of error messages is undesirable, then the value $1$ is recommended. Otherwise, if you are not familiar with this parameter, the recommended value is $0$. When the value $-\mathbf{1}\text{ or }\mathbf{1}$ is used it is essential to test the value of IFAIL on exit.

On exit: $\mathbf{IFAIL}=\mathbf{0}$ unless the routine detects an error or a warning has been flagged (see Section 6).

6  Error Indicators and Warnings

$\mathbf{IFAIL}=1$

On entry, $\mathbf{LDZ}<\max \left(1,\mathbf{N}\right)$ or $\mathbf{LDZ}<1$ when no vectors are required.

$\mathbf{IFAIL}=2$

On entry, the option $\mathbf{Vectors}=\text{Select}$ was selected, but this is not yet implemented.

$\mathbf{IFAIL}=3$

The number of eigenvalues found to sufficient accuracy prior to calling F12AQF, as communicated through the parameter ICOMM, is zero.

$\mathbf{IFAIL}=4$

The number of converged eigenvalues as calculated by F12APF differ from the value passed to it through the parameter ICOMM.

$\mathbf{IFAIL}=5$

Unexpected error during calculation of a Schur form: there was a failure to compute all the converged eigenvalues. Please contact NAG.

$\mathbf{IFAIL}=6$

Unexpected error: the computed Schur form could not be reordered by an internal call. Please contact NAG.

$\mathbf{IFAIL}=7$

Unexpected error in internal call while calculating eigenvectors. Please contact NAG.

$\mathbf{IFAIL}=8$

Either the solver routine F12APF has not been called prior to the call of this routine or a communication array has become corrupted.

$\mathbf{IFAIL}=9$

The routine was unable to dynamically allocate sufficient internal workspace. Please contact NAG.

$\mathbf{IFAIL}=10$

An unexpected error has occurred. Please contact NAG.

$\mathbf{IFAIL}=-99$

An unexpected error has been triggered by this routine. Please contact NAG.

See Section 3.8 in the Essential Introduction for further information.

$\mathbf{IFAIL}=-399$

Your licence key may have expired or may not have been installed correctly.

See Section 3.7 in the Essential Introduction for further information.

$\mathbf{IFAIL}=-999$

Dynamic memory allocation failed.

See Section 3.6 in the Essential Introduction for further information.

7  Accuracy

8  Parallelism and Performance

9  Further Comments

10  Example

10.1  Program Text

Program Text (f12aqfe.f90)

10.2  Program Data

Program Data (f12aqfe.d)

10.3  Program Results

Program Results (f12aqfe.r)