f01kdf computes an estimate of the relative condition number, , and a bound on the relative residual, in the Frobenius norm, for the square root of a complex matrix . The principal square root, , of is also returned.
The computed quantity is a measure of the stability of the relative residual (see Section 7). It is computed via
Björck Å and Hammarling S (1983) A Schur method for the square root of a matrix Linear Algebra Appl.52/53 127–140
Deadman E, Higham N J and Ralha R (2013) Blocked Schur Algorithms for Computing the Matrix Square Root Applied Parallel and Scientific Computing: 11th International Conference, (PARA 2012, Helsinki, Finland) P. Manninen and P. Öster, Eds Lecture Notes in Computer Science7782 171–181 Springer–Verlag
Higham N J (1987) Computing real square roots of a real matrix Linear Algebra Appl.88/89 405–430
Higham N J (2008) Functions of Matrices: Theory and Computation SIAM, Philadelphia, PA, USA
1: – IntegerInput
On entry: , the order of the matrix .
2: – Complex (Kind=nag_wp) arrayInput/Output
Note: the second dimension of the array a
must be at least
On entry: the matrix .
On exit: the principal matrix square root . Alternatively, if , contains an non-principal square root of .
3: – IntegerInput
On entry: the first dimension of the array a as declared in the (sub)program from which f01kdf is called.
4: – Real (Kind=nag_wp)Output
On exit: an estimate of the stability of the relative residual for the computed principal (if ) or non-principal (if ) matrix square root, .
5: – Real (Kind=nag_wp)Output
On exit: an estimate of the relative condition number, in the Frobenius norm, of the principal (if ) or non-principal (if ) matrix square root at , .
6: – IntegerInput/Output
On entry: ifail must be set to , or to set behaviour on detection of an error; these values have no effect when no error is detected.
A value of causes the printing of an error message and program execution will be halted; otherwise program execution continues. A value of means that an error message is printed while a value of means that it is not.
If halting is not appropriate, the value or is recommended. If message printing is undesirable, then the value is recommended. Otherwise, the value is recommended. When the value or is used it is essential to test the value of ifail on exit.
On exit: unless the routine detects an error or a warning has been flagged (see Section 6).
6Error Indicators and Warnings
If on entry or , explanatory error messages are output on the current error message unit (as defined by x04aaf).
Errors or warnings detected by the routine:
has a negative or semisimple vanishing eigenvalue. A non-principal square root was returned.
has a defective vanishing eigenvalue. The square root and condition number cannot be found in this case.
An error occurred when computing the matrix square root. Consequently, alpha and condsa could not be computed. It is likely that the routine was called incorrectly.
An error occurred when computing the condition number. The matrix square root was still returned but you should use f01fnf to check if it is the principal matrix square root.
On entry, .
On entry, and .
An unexpected error has been triggered by this routine. Please
See Section 7 in the Introduction to the NAG Library FL Interface for further information.
Your licence key may have expired or may not have been installed correctly.
See Section 8 in the Introduction to the NAG Library FL Interface for further information.
Dynamic memory allocation failed.
See Section 9 in the Introduction to the NAG Library FL Interface for further information.
If the computed square root is , then the relative residual
is bounded approximately by , where is machine precision. The relative error in is bounded approximately by .
8Parallelism and Performance
f01kdf is threaded by NAG for parallel execution in multithreaded implementations of the NAG Library.
f01kdf makes calls to BLAS and/or LAPACK routines, which may be threaded within the vendor library used by this implementation. Consult the documentation for the vendor library for further information.
Please consult the X06 Chapter Introduction for information on how to control and interrogate the OpenMP environment used within this routine. Please also consult the Users' Note for your implementation for any additional implementation-specific information.
Approximately of complex allocatable memory is required by the routine.
The cost of computing the matrix square root is floating-point operations. The cost of computing the condition number depends on how fast the algorithm converges. It typically takes over twice as long as computing the matrix square root.
If condition estimates are not required then it is more efficient to use f01fnf to obtain the matrix square root alone. Condition estimates for the square root of a real matrix can be obtained via f01jdf.
This example estimates the matrix square root and condition number of the matrix