Published April 21, 2016 | Version v1
Journal article

On the accuracy of the Padé-resummed master equation approach to dissipative quantum dynamics

  • 1. Department of Chemistry, Columbia University, 3000 Broadway, New York, New York 10027 (United States)
  • 2. Princeton Center for Theoretical Science, Princeton University, Princeton, New Jersey 08544 (United States)

Description

Well-defined criteria are proposed for assessing the accuracy of quantum master equations whose memory functions are approximated by Padé resummation of the first two moments in the electronic coupling. These criteria partition the parameter space into distinct levels of expected accuracy, ranging from quantitatively accurate regimes to regions of parameter space where the approach is not expected to be applicable. Extensive comparison of Padé-resummed master equations with numerically exact results in the context of the spin–boson model demonstrates that the proposed criteria correctly demarcate the regions of parameter space where the Padé approximation is reliable. The applicability analysis we present is not confined to the specifics of the Hamiltonian under consideration and should provide guidelines for other classes of resummation techniques.

Additional details

Identifiers

Publishing Information

Journal Title
Journal of Chemical Physics
Journal Volume
144
Journal Issue
15
Journal Page Range
vp.
ISSN
0021-9606
CODEN
JCPSA6

INIS

Country of Publication
United States
Country of Input or Organization
International Atomic Energy Agency (IAEA)
INIS RN
49006319
Subject category
S37: INORGANIC, ORGANIC, PHYSICAL AND ANALYTICAL CHEMISTRY;
Resource subtype / Literary indicator
Numerical Data
Descriptors DEI
ACCURACY; BOSONS; EQUATIONS; EXPERIMENTAL DATA; HAMILTONIANS; SPIN
Descriptors DEC
ANGULAR MOMENTUM; DATA; INFORMATION; MATHEMATICAL OPERATORS; NUMERICAL DATA; PARTICLE PROPERTIES; QUANTUM OPERATORS

Optional Information

Notes
(c) 2016 Author(s)