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High-order correction to the Trotter expansion for use in computer simulation.

Authors :
Li, Xiao-Ping
Broughton, Jeremy Q.
Source :
Journal of Chemical Physics. 5/1/1987, Vol. 86 Issue 9, p5094. 7p.
Publication Year :
1987

Abstract

A convenient form of the generalized Trotter formula for path-integral simulations has been investigated for various systems and proves to be much better than the primitive. The hydrogen atom, which is pathological for the primitive algorithm, is solved by the new method but the results are not completely satisfactory. [ABSTRACT FROM AUTHOR]

Details

Language :
English
ISSN :
00219606
Volume :
86
Issue :
9
Database :
Academic Search Index
Journal :
Journal of Chemical Physics
Publication Type :
Academic Journal
Accession number :
7667425
Full Text :
https://doi.org/10.1063/1.452653