Multichannel quantum defect theory for cold molecular collisions
Creators
- 1. Joint Quantum Institute, NIST and the University of Maryland, Gaithersburg, Maryland 20899-8423 (United States)
- 2. Department of Chemistry, Durham University, South Road, Durham DH1 3LE (United Kingdom)
Description
Multichannel quantum defect theory (MQDT) is shown to be capable of producing quantitatively accurate results for low-energy atom-molecule scattering calculations. With a suitable choice of reference potential and short-range matching distance, it is possible to define a matrix that encapsulates the short-range collision dynamics and is only weakly dependent on energy and magnetic field. Once this has been produced, calculations at additional energies and fields can be performed at a computational cost that is proportional to the number of channels N and not to N3. MQDT thus provides a promising method for carrying out low-energy molecular scattering calculations on systems where full exploration of the energy dependence and the field dependence is currently impractical.
Additional details
Identifiers
- DOI
- 10.1103/PhysRevA.84.042703;
- arXiv
- arXiv:1105.4483v2;
Publishing Information
- Journal Title
- Physical Review. A
- Journal Volume
- 84
- Journal Issue
- 4
- Journal Page Range
- p. 042703-042703.9
- ISSN
- 1050-2947
- CODEN
- PLRAAN
INIS
- Country of Publication
- United States
- Country of Input or Organization
- International Atomic Energy Agency (IAEA)
- INIS RN
- 44053489
- Subject category
- S74: ATOMIC AND MOLECULAR PHYSICS;
- Descriptors DEI
- ATOM-MOLECULE COLLISIONS; ENERGY DEPENDENCE; MAGNETIC FIELDS; QUANTUM MECHANICS; SCATTERING
- Descriptors DEC
- ATOM COLLISIONS; COLLISIONS; MECHANICS; MOLECULE COLLISIONS
Optional Information
- Notes
- (c) 2011 American Institute of Physics