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LAPACK 3.12.0
LAPACK: Linear Algebra PACKage
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LAPACK 3.12.0
LAPACK: Linear Algebra PACKage
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| subroutine zgedmd | ( | character, intent(in) | jobs, |
| character, intent(in) | jobz, | ||
| character, intent(in) | jobr, | ||
| character, intent(in) | jobf, | ||
| integer, intent(in) | whtsvd, | ||
| integer, intent(in) | m, | ||
| integer, intent(in) | n, | ||
| complex(kind=wp), dimension(ldx,*), intent(inout) | x, | ||
| integer, intent(in) | ldx, | ||
| complex(kind=wp), dimension(ldy,*), intent(inout) | y, | ||
| integer, intent(in) | ldy, | ||
| integer, intent(in) | nrnk, | ||
| real(kind=wp), intent(in) | tol, | ||
| integer, intent(out) | k, | ||
| complex(kind=wp), dimension(*), intent(out) | eigs, | ||
| complex(kind=wp), dimension(ldz,*), intent(out) | z, | ||
| integer, intent(in) | ldz, | ||
| real(kind=wp), dimension(*), intent(out) | res, | ||
| complex(kind=wp), dimension(ldb,*), intent(out) | b, | ||
| integer, intent(in) | ldb, | ||
| complex(kind=wp), dimension(ldw,*), intent(out) | w, | ||
| integer, intent(in) | ldw, | ||
| complex(kind=wp), dimension(lds,*), intent(out) | s, | ||
| integer, intent(in) | lds, | ||
| complex(kind=wp), dimension(*), intent(out) | zwork, | ||
| integer, intent(in) | lzwork, | ||
| real(kind=wp), dimension(*), intent(out) | rwork, | ||
| integer, intent(in) | lrwork, | ||
| integer, dimension(*), intent(out) | iwork, | ||
| integer, intent(in) | liwork, | ||
| integer, intent(out) | info | ||
| ) |
ZGEDMD computes the Dynamic Mode Decomposition (DMD) for a pair of data snapshot matrices.
ZGEDMD computes the Dynamic Mode Decomposition (DMD) for
a pair of data snapshot matrices. For the input matrices
X and Y such that Y = A*X with an unaccessible matrix
A, ZGEDMD computes a certain number of Ritz pairs of A using
the standard Rayleigh-Ritz extraction from a subspace of
range(X) that is determined using the leading left singular
vectors of X. Optionally, ZGEDMD returns the residuals
of the computed Ritz pairs, the information needed for
a refinement of the Ritz vectors, or the eigenvectors of
the Exact DMD.
For further details see the references listed
below. For more details of the implementation see [3]. [1] P. Schmid: Dynamic mode decomposition of numerical
and experimental data,
Journal of Fluid Mechanics 656, 5-28, 2010.
[2] Z. Drmac, I. Mezic, R. Mohr: Data driven modal
decompositions: analysis and enhancements,
SIAM J. on Sci. Comp. 40 (4), A2253-A2285, 2018.
[3] Z. Drmac: A LAPACK implementation of the Dynamic
Mode Decomposition I. Technical report. AIMDyn Inc.
and LAPACK Working Note 298.
[4] J. Tu, C. W. Rowley, D. M. Luchtenburg, S. L.
Brunton, N. Kutz: On Dynamic Mode Decomposition:
Theory and Applications, Journal of Computational
Dynamics 1(2), 391 -421, 2014. Developed and coded by Zlatko Drmac, Faculty of Science,
University of Zagreb; drmac@math.hr
In cooperation with
AIMdyn Inc., Santa Barbara, CA.
and supported by
- DARPA SBIR project "Koopman Operator-Based Forecasting
for Nonstationary Processes from Near-Term, Limited
Observational Data" Contract No: W31P4Q-21-C-0007
- DARPA PAI project "Physics-Informed Machine Learning
Methodologies" Contract No: HR0011-18-9-0033
- DARPA MoDyL project "A Data-Driven, Operator-Theoretic
Framework for Space-Time Analysis of Process Dynamics"
Contract No: HR0011-16-C-0116
Any opinions, findings and conclusions or recommendations
expressed in this material are those of the author and
do not necessarily reflect the views of the DARPA SBIR
Program Office Approved for Public Release, Distribution Unlimited.
Cleared by DARPA on September 29, 2022 | [in] | JOBS | JOBS (input) CHARACTER*1
Determines whether the initial data snapshots are scaled
by a diagonal matrix.
'S' :: The data snapshots matrices X and Y are multiplied
with a diagonal matrix D so that X*D has unit
nonzero columns (in the Euclidean 2-norm)
'C' :: The snapshots are scaled as with the 'S' option.
If it is found that an i-th column of X is zero
vector and the corresponding i-th column of Y is
non-zero, then the i-th column of Y is set to
zero and a warning flag is raised.
'Y' :: The data snapshots matrices X and Y are multiplied
by a diagonal matrix D so that Y*D has unit
nonzero columns (in the Euclidean 2-norm)
'N' :: No data scaling. |
| [in] | JOBZ | JOBZ (input) CHARACTER*1
Determines whether the eigenvectors (Koopman modes) will
be computed.
'V' :: The eigenvectors (Koopman modes) will be computed
and returned in the matrix Z.
See the description of Z.
'F' :: The eigenvectors (Koopman modes) will be returned
in factored form as the product X(:,1:K)*W, where X
contains a POD basis (leading left singular vectors
of the data matrix X) and W contains the eigenvectors
of the corresponding Rayleigh quotient.
See the descriptions of K, X, W, Z.
'N' :: The eigenvectors are not computed. |
| [in] | JOBR | JOBR (input) CHARACTER*1
Determines whether to compute the residuals.
'R' :: The residuals for the computed eigenpairs will be
computed and stored in the array RES.
See the description of RES.
For this option to be legal, JOBZ must be 'V'.
'N' :: The residuals are not computed. |
| [in] | JOBF | JOBF (input) CHARACTER*1
Specifies whether to store information needed for post-
processing (e.g. computing refined Ritz vectors)
'R' :: The matrix needed for the refinement of the Ritz
vectors is computed and stored in the array B.
See the description of B.
'E' :: The unscaled eigenvectors of the Exact DMD are
computed and returned in the array B. See the
description of B.
'N' :: No eigenvector refinement data is computed. |
| [in] | WHTSVD | WHTSVD (input) INTEGER, WHSTVD in { 1, 2, 3, 4 }
Allows for a selection of the SVD algorithm from the
LAPACK library.
1 :: ZGESVD (the QR SVD algorithm)
2 :: ZGESDD (the Divide and Conquer algorithm; if enough
workspace available, this is the fastest option)
3 :: ZGESVDQ (the preconditioned QR SVD ; this and 4
are the most accurate options)
4 :: ZGEJSV (the preconditioned Jacobi SVD; this and 3
are the most accurate options)
For the four methods above, a significant difference in
the accuracy of small singular values is possible if
the snapshots vary in norm so that X is severely
ill-conditioned. If small (smaller than EPS*||X||)
singular values are of interest and JOBS=='N', then
the options (3, 4) give the most accurate results, where
the option 4 is slightly better and with stronger
theoretical background.
If JOBS=='S', i.e. the columns of X will be normalized,
then all methods give nearly equally accurate results. |
| [in] | M | M (input) INTEGER, M>= 0
The state space dimension (the row dimension of X, Y). |
| [in] | N | N (input) INTEGER, 0 <= N <= M
The number of data snapshot pairs
(the number of columns of X and Y). |
| [in] | LDX | X (input/output) COMPLEX(KIND=WP) M-by-N array
> On entry, X contains the data snapshot matrix X. It is
assumed that the column norms of X are in the range of
the normalized floating point numbers.
< On exit, the leading K columns of X contain a POD basis,
i.e. the leading K left singular vectors of the input
data matrix X, U(:,1:K). All N columns of X contain all
left singular vectors of the input matrix X.
See the descriptions of K, Z and W.
LDX (input) INTEGER, LDX >= M
The leading dimension of the array X. |
| [in,out] | Y | Y (input/workspace/output) COMPLEX(KIND=WP) M-by-N array
> On entry, Y contains the data snapshot matrix Y
< On exit,
If JOBR == 'R', the leading K columns of Y contain
the residual vectors for the computed Ritz pairs.
See the description of RES.
If JOBR == 'N', Y contains the original input data,
scaled according to the value of JOBS. |
| [in] | LDY | LDY (input) INTEGER , LDY >= M
The leading dimension of the array Y. |
| [in] | NRNK | NRNK (input) INTEGER
Determines the mode how to compute the numerical rank,
i.e. how to truncate small singular values of the input
matrix X. On input, if
NRNK = -1 :: i-th singular value sigma(i) is truncated
if sigma(i) <= TOL*sigma(1)
This option is recommended.
NRNK = -2 :: i-th singular value sigma(i) is truncated
if sigma(i) <= TOL*sigma(i-1)
This option is included for R&D purposes.
It requires highly accurate SVD, which
may not be feasible.
The numerical rank can be enforced by using positive
value of NRNK as follows:
0 < NRNK <= N :: at most NRNK largest singular values
will be used. If the number of the computed nonzero
singular values is less than NRNK, then only those
nonzero values will be used and the actually used
dimension is less than NRNK. The actual number of
the nonzero singular values is returned in the variable
K. See the descriptions of TOL and K. |
| [in] | TOL | TOL (input) REAL(KIND=WP), 0 <= TOL < 1
The tolerance for truncating small singular values.
See the description of NRNK. |
| [out] | K | K (output) INTEGER, 0 <= K <= N
The dimension of the POD basis for the data snapshot
matrix X and the number of the computed Ritz pairs.
The value of K is determined according to the rule set
by the parameters NRNK and TOL.
See the descriptions of NRNK and TOL. |
| [out] | EIGS | EIGS (output) COMPLEX(KIND=WP) N-by-1 array
The leading K (K<=N) entries of EIGS contain
the computed eigenvalues (Ritz values).
See the descriptions of K, and Z. |
| [out] | Z | Z (workspace/output) COMPLEX(KIND=WP) M-by-N array
If JOBZ =='V' then Z contains the Ritz vectors. Z(:,i)
is an eigenvector of the i-th Ritz value; ||Z(:,i)||_2=1.
If JOBZ == 'F', then the Z(:,i)'s are given implicitly as
the columns of X(:,1:K)*W(1:K,1:K), i.e. X(:,1:K)*W(:,i)
is an eigenvector corresponding to EIGS(i). The columns
of W(1:k,1:K) are the computed eigenvectors of the
K-by-K Rayleigh quotient.
See the descriptions of EIGS, X and W. |
| [in] | LDZ | LDZ (input) INTEGER , LDZ >= M
The leading dimension of the array Z. |
| [out] | RES | RES (output) REAL(KIND=WP) N-by-1 array
RES(1:K) contains the residuals for the K computed
Ritz pairs,
RES(i) = || A * Z(:,i) - EIGS(i)*Z(:,i))||_2.
See the description of EIGS and Z. |
| [out] | B | B (output) COMPLEX(KIND=WP) M-by-N array.
IF JOBF =='R', B(1:M,1:K) contains A*U(:,1:K), and can
be used for computing the refined vectors; see further
details in the provided references.
If JOBF == 'E', B(1:M,1:K) contains
A*U(:,1:K)*W(1:K,1:K), which are the vectors from the
Exact DMD, up to scaling by the inverse eigenvalues.
If JOBF =='N', then B is not referenced.
See the descriptions of X, W, K. |
| [in] | LDB | LDB (input) INTEGER, LDB >= M
The leading dimension of the array B. |
| [out] | W | W (workspace/output) COMPLEX(KIND=WP) N-by-N array
On exit, W(1:K,1:K) contains the K computed
eigenvectors of the matrix Rayleigh quotient.
The Ritz vectors (returned in Z) are the
product of X (containing a POD basis for the input
matrix X) and W. See the descriptions of K, S, X and Z.
W is also used as a workspace to temporarily store the
right singular vectors of X. |
| [in] | LDW | LDW (input) INTEGER, LDW >= N
The leading dimension of the array W. |
| [out] | S | S (workspace/output) COMPLEX(KIND=WP) N-by-N array
The array S(1:K,1:K) is used for the matrix Rayleigh
quotient. This content is overwritten during
the eigenvalue decomposition by ZGEEV.
See the description of K. |
| [in] | LDS | LDS (input) INTEGER, LDS >= N
The leading dimension of the array S. |
| [out] | ZWORK | ZWORK (workspace/output) COMPLEX(KIND=WP) LZWORK-by-1 array
ZWORK is used as complex workspace in the complex SVD, as
specified by WHTSVD (1,2, 3 or 4) and for ZGEEV for computing
the eigenvalues of a Rayleigh quotient.
If the call to ZGEDMD is only workspace query, then
ZWORK(1) contains the minimal complex workspace length and
ZWORK(2) is the optimal complex workspace length.
Hence, the length of work is at least 2.
See the description of LZWORK. |
| [in] | LZWORK | LZWORK (input) INTEGER
The minimal length of the workspace vector ZWORK.
LZWORK is calculated as MAX(LZWORK_SVD, LZWORK_ZGEEV),
where LZWORK_ZGEEV = MAX( 1, 2*N ) and the minimal
LZWORK_SVD is calculated as follows
If WHTSVD == 1 :: ZGESVD ::
LZWORK_SVD = MAX(1,2*MIN(M,N)+MAX(M,N))
If WHTSVD == 2 :: ZGESDD ::
LZWORK_SVD = 2*MIN(M,N)*MIN(M,N)+2*MIN(M,N)+MAX(M,N)
If WHTSVD == 3 :: ZGESVDQ ::
LZWORK_SVD = obtainable by a query
If WHTSVD == 4 :: ZGEJSV ::
LZWORK_SVD = obtainable by a query
If on entry LZWORK = -1, then a workspace query is
assumed and the procedure only computes the minimal
and the optimal workspace lengths and returns them in
LZWORK(1) and LZWORK(2), respectively. |
| [out] | RWORK | RWORK (workspace/output) REAL(KIND=WP) LRWORK-by-1 array
On exit, RWORK(1:N) contains the singular values of
X (for JOBS=='N') or column scaled X (JOBS=='S', 'C').
If WHTSVD==4, then RWORK(N+1) and RWORK(N+2) contain
scaling factor RWORK(N+2)/RWORK(N+1) used to scale X
and Y to avoid overflow in the SVD of X.
This may be of interest if the scaling option is off
and as many as possible smallest eigenvalues are
desired to the highest feasible accuracy.
If the call to ZGEDMD is only workspace query, then
RWORK(1) contains the minimal workspace length.
See the description of LRWORK. |
| [in] | LRWORK | LRWORK (input) INTEGER
The minimal length of the workspace vector RWORK.
LRWORK is calculated as follows:
LRWORK = MAX(1, N+LRWORK_SVD,N+LRWORK_ZGEEV), where
LRWORK_ZGEEV = MAX(1,2*N) and RWORK_SVD is the real workspace
for the SVD subroutine determined by the input parameter
WHTSVD.
If WHTSVD == 1 :: ZGESVD ::
LRWORK_SVD = 5*MIN(M,N)
If WHTSVD == 2 :: ZGESDD ::
LRWORK_SVD = MAX(5*MIN(M,N)*MIN(M,N)+7*MIN(M,N),
2*MAX(M,N)*MIN(M,N)+2*MIN(M,N)*MIN(M,N)+MIN(M,N) ) )
If WHTSVD == 3 :: ZGESVDQ ::
LRWORK_SVD = obtainable by a query
If WHTSVD == 4 :: ZGEJSV ::
LRWORK_SVD = obtainable by a query
If on entry LRWORK = -1, then a workspace query is
assumed and the procedure only computes the minimal
real workspace length and returns it in RWORK(1). |
| [out] | IWORK | IWORK (workspace/output) INTEGER LIWORK-by-1 array
Workspace that is required only if WHTSVD equals
2 , 3 or 4. (See the description of WHTSVD).
If on entry LWORK =-1 or LIWORK=-1, then the
minimal length of IWORK is computed and returned in
IWORK(1). See the description of LIWORK. |
| [in] | LIWORK | LIWORK (input) INTEGER
The minimal length of the workspace vector IWORK.
If WHTSVD == 1, then only IWORK(1) is used; LIWORK >=1
If WHTSVD == 2, then LIWORK >= MAX(1,8*MIN(M,N))
If WHTSVD == 3, then LIWORK >= MAX(1,M+N-1)
If WHTSVD == 4, then LIWORK >= MAX(3,M+3*N)
If on entry LIWORK = -1, then a workspace query is
assumed and the procedure only computes the minimal
and the optimal workspace lengths for ZWORK, RWORK and
IWORK. See the descriptions of ZWORK, RWORK and IWORK. |
| [out] | INFO | INFO (output) INTEGER
-i < 0 :: On entry, the i-th argument had an
illegal value
= 0 :: Successful return.
= 1 :: Void input. Quick exit (M=0 or N=0).
= 2 :: The SVD computation of X did not converge.
Suggestion: Check the input data and/or
repeat with different WHTSVD.
= 3 :: The computation of the eigenvalues did not
converge.
= 4 :: If data scaling was requested on input and
the procedure found inconsistency in the data
such that for some column index i,
X(:,i) = 0 but Y(:,i) /= 0, then Y(:,i) is set
to zero if JOBS=='C'. The computation proceeds
with original or modified data and warning
flag is set with INFO=4. |
Definition at line 493 of file zgedmd.f90.
1.9.7