Published May 2009
| Version v1
Journal article
Acceleration of quantum optimal control theory algorithms with mixing strategies
Creators
- 1. Institut fuer Theoretische Physik and European Theoretical Spectroscopy Facility, Freie Universitaet Berlin, Arnimallee 14, D-14195 Berlin (Germany)
Description
We propose the use of mixing strategies to accelerate the convergence of the common iterative algorithms utilized in quantum optimal control theory (QOCT). We show how the nonlinear equations of QOCT can be viewed as a 'fixed-point' nonlinear problem. The iterative algorithms for this class of problems may benefit from mixing strategies, as it happens, e.g., in the quest for the ground-state density in Kohn-Sham density-functional theory. We demonstrate, with some numerical examples, how the same mixing schemes utilized in this latter nonlinear problem may significantly accelerate the QOCT iterative procedures.
Additional details
Identifiers
Publishing Information
- Journal Title
- Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics (Print)
- Journal Volume
- 79
- Journal Issue
- 5
- Journal Page Range
- p. 056704-056704.7
- ISSN
- 1539-3755
INIS
- Country of Publication
- United States
- Country of Input or Organization
- International Atomic Energy Agency (IAEA)
- INIS RN
- 41040189
- Subject category
- S97: MATHEMATICAL METHODS AND COMPUTING;
- Descriptors DEI
- ACCELERATION; ALGORITHMS; CONVERGENCE; DENSITY FUNCTIONAL METHOD; EQUATIONS; GROUND STATES; ITERATIVE METHODS; NONLINEAR PROBLEMS; OPTIMAL CONTROL
- Descriptors DEC
- CALCULATION METHODS; CONTROL; ENERGY LEVELS; MATHEMATICAL LOGIC; VARIATIONAL METHODS
Optional Information
- Notes
- (c) 2009 The American Physical Society