Condensed Matter Physics, 2006, vol. 9, No. 4(48), p.637-644, English
DOI:10.5488/CMP.9.4.637
Title:
Kinetic theory of non-hamiltonian statistical ensembles
Author(s):
 
| A.V.Zhukov
(Department of Chemistry, Massachusetts Institute of
Technology, Cambridge, MA 02139, USA; Department of
Chemistry, University of Western Ontario, London, Ontario, N6A
5B7, Canada)
,
|
 
| J.Cao
(Department of Chemistry, Massachusetts Institute of
Technology, Cambridge, MA 02139, USA)
|
A nonequilibrium statistical operator method is developed for
ensembles of particles obeying non-Hamiltonian equations of motion
in classical phase space. The main consequences of non-zero
compressibility of phase space are examined in terms of
time-dependent dynamic quantities. The generalized transport
equations involve the phase-space compressibility in a non-trivial
way. Our results are useful in molecular dynamics simulation
studies as well as nonequilibrium or quasiclassical
approximations of quantum-classical dynamics.
Key words:
non-Hamiltonian systems, nonequilibrium statistical
operator, Zubarev formalism, molecular dynamics
PACS:
05.20.-y, 05.20.Gg, 82.20.-w
|