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A hybrid hydrodynamic-Liouvillian approach to mixed quantum-classical dynamics: application to tunneling in a double well.
Hughes KH, Parry SM, Parlant G, Burghardt I. Hughes KH, et al. Among authors: burghardt i. J Phys Chem A. 2007 Oct 18;111(41):10269-83. doi: 10.1021/jp072642f. Epub 2007 Aug 9. J Phys Chem A. 2007. PMID: 17685595
The hybrid quantum-classical approach of Burghardt and Parlant [Burghardt, I.; Parlant, G. J. Chem. Phys. 2004, 120, 3055], referred to here as the quantum-classical moment (QCM) approach, is demonstrated for the dynamics of a quantum double well coupled to a …
The hybrid quantum-classical approach of Burghardt and Parlant [Burghardt, I.; Parlant, G. J. Chem. Phys. 2004, 120, 30 …
Closure of quantum hydrodynamic moment equations.
Hughes KH, Parry SM, Burghardt I. Hughes KH, et al. Among authors: burghardt i. J Chem Phys. 2009 Feb 7;130(5):054115. doi: 10.1063/1.3073759. J Chem Phys. 2009. PMID: 19206966
Extended hydrodynamic approach to quantum-classical nonequilibrium evolution. I. Theory.
Bousquet D, Hughes KH, Micha DA, Burghardt I. Bousquet D, et al. Among authors: burghardt i. J Chem Phys. 2011 Feb 14;134(6):064116. doi: 10.1063/1.3553174. J Chem Phys. 2011. PMID: 21322670
The quantum-classical limit is subsequently taken and the resulting hierarchy of equations is further approximated by various closure schemes. These include, in particular, (i) a Grad-Hermite-type closure, (ii) a Gaussian closure at the level of a quantum-classical local M …
The quantum-classical limit is subsequently taken and the resulting hierarchy of equations is further approximated by various closure scheme …
Unraveling a Brownian particle's memory with effective mode chains.
Martinazzo R, Hughes KH, Burghardt I. Martinazzo R, et al. Among authors: burghardt i. Phys Rev E Stat Nonlin Soft Matter Phys. 2011 Sep;84(3 Pt 1):030102. doi: 10.1103/PhysRevE.84.030102. Epub 2011 Sep 14. Phys Rev E Stat Nonlin Soft Matter Phys. 2011. PMID: 22060317
Extended hydrodynamic approach to quantum-classical nonequilibrium evolution. II. Application to nonpolar solvation.
Hughes KH, Baxter SN, Bousquet D, Ramanathan P, Burghardt I. Hughes KH, et al. Among authors: burghardt i. J Chem Phys. 2012 Jan 7;136(1):014102. doi: 10.1063/1.3671378. J Chem Phys. 2012. PMID: 22239764
The mixed quantum-classical formulation derived in our companion paper [D. Bousquet, K. H. Hughes, D. Micha, and I. Burghardt, J. Chem. Phys. 134, 064116 (2011)], which is based upon a hydrodynamic representation of the classical sector, is applied to nonequilibrium …
The mixed quantum-classical formulation derived in our companion paper [D. Bousquet, K. H. Hughes, D. Micha, and I. Burghardt, …
135 results