Publications

Author Title Type [ Year(Asc)]
Filters: Keyword is Degrees of freedom (mechanics)  [Clear All Filters]
2017
Colberg, P. H. ; Kapral, R. . Many-Body Dynamics Of Chemically Propelled Nanomotors. Journal of Chemical Physics 2017, 147.
2007
Grunwald, R. ; Kapral, R. . Decoherence And Quantum-Classical Master Equation Dynamics. Journal of Chemical Physics 2007, 126.PDF icon PDF (279.89 KB)
2006
Kapral, R. . Progress In The Theory Of Mixed Quantum-Classical Dynamics. Annual Review of Physical Chemistry, 2006, 57, 129-157.
2005
Sergi, A. ; Kapral, R. . Nonadiabatic Chemical Reactions. Computer Physics Communications 2005, 169, 400-403.PDF icon PDF (100.72 KB)
Hanna, G. ; Kapral, R. . Quantum-Classical Liouville Dynamics Of Nonadiabatic Proton Transfer. Journal of Chemical Physics 2005, 122.PDF icon PDF (173.48 KB)
2004
Sergi, A. ; Kapral, R. . Quantum-Classical Limit Of Quantum Correlation Functions. Journal of Chemical Physics 2004, 121, 7565-7576.PDF icon PDF (185.98 KB)
2003
Sergi, A. ; Kapral, R. . Nonadiabatic Reaction Rates For Dissipative Quantum-Classical Systems. Journal of Chemical Physics 2003, 119, 12776-12783.PDF icon PDF (127.51 KB)
Sergi, A. ; Kapral, R. . Quantum-Classical Dynamics Of Nonadiabatic Chemical Reactions. Journal of Chemical Physics 2003, 118, 8566-8575.PDF icon PDF (155.66 KB)
2002
Shiokawa, K. ; Kapral, R. . Emergence Of Quantum-Classical Dynamics In An Open Quantum Environment. Journal of Chemical Physics 2002, 117, 7852-7863.PDF icon PDF (176.42 KB)
MacKernan, D. ; Kapral, R. ; Ciccotti, G. . Sequential Short-Time Propagation Of Quantum-Classical Dynamics. Journal of Physics Condensed Matter 2002, 14, 9069-9076.PDF icon PDF (116.71 KB)
2001
Kapral, R. . Quantum-Classical Dynamics In A Classical Bath. Journal of Physical Chemistry A 2001, 105, 2885-2889.PDF icon PDF (270.41 KB)
Nielsen, S. ; Kapral, R. ; Ciccotti, G. . Statistical Mechanics Of Quantum-Classical Systems. Journal of Chemical Physics 2001, 115, 5805-5815.PDF icon PDF (1.12 MB)