On the calculation of time correlation functions in quantum systems: Path integral techniquesa)
- 15 November 1983
- journal article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 79 (10) , 5029-5033
- https://doi.org/10.1063/1.445597
Abstract
A Monte Carlo method for calculating quantum mechanical time correlation functions is presented. In this method the time correlation function is calculated at several values along the pure imaginary axis of the complex time plane such that 0<it<β, where (β)−1 is the temperature of the system. Using the periodicity of the imaginary time correlation function, the real time behavior is inferred by analytic continuation. The method is used to calculate the absorption spectra of two model systems.Keywords
This publication has 8 references indexed in Scilit:
- An iterative scheme for the evaluation of discretized path integralsThe Journal of Chemical Physics, 1983
- Electronic States of a Topologically Disordered System: Exact Solution of the Mean Spherical Model for LiquidsPhysical Review Letters, 1982
- Monte Carlo evaluation of path integrals: Quantal intramolecular degrees of freedom in solutionThe Journal of Chemical Physics, 1982
- On path integral Monte Carlo simulationsThe Journal of Chemical Physics, 1982
- Convenient and accurate discretized path integral methods for equilibrium quantum mechanical calculationsThe Journal of Chemical Physics, 1981
- Exploiting the isomorphism between quantum theory and classical statistical mechanics of polyatomic fluidsThe Journal of Chemical Physics, 1981
- Correlation Functions for Molecular MotionPublished by Elsevier ,1968
- Determination of Thermodynamic Green's FunctionsJournal of Mathematical Physics, 1961