Published May 2009 | Version v1
Journal article

Acceleration of quantum optimal control theory algorithms with mixing strategies

  • 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