690 citations
Counting papers with at most 25 authors, so collaboration author lists do not stand in for the people here.
- National Institutes of HealthUS46 papers
- Seoul National UniversityKR5 papers
- Korea Institute for Advanced StudyKR4 papers
- Quảng Bình UniversityVN4 papers
- The University of Texas at AustinUS4 papers
- Keimyung UniversityKR3 papers
- Lehigh UniversityUS3 papers
- Princeton UniversityUS3 papers
- University at Buffalo, State University of New YorkUS3 papers
- University of ViennaAT3 papers
- Asia Pacific Center for Theoretical PhysicsKR2 papers
- Centre National de la Recherche ScientifiqueFR2 papers
6 papers · 1 filter
Optimal estimators and asymptotic variances for nonequilibrium path-ensemble averages
David D. L. Minh, John D. Chodera
Existing optimal estimators of nonequilibrium path-ensemble averages are shown to fall within the framework of extended bridge sampling. Using this framework, we derive a general m…
Comment on "On the Crooks fluctuation theorem and the Jarzynski equality" [J. Chem. Phys. 129, 091101 (2008)]
Artur B. Adib
It has recently been argued that a self-consistency condition involving the Jarzynski equality (JE) and the Crooks fluctuation theorem (CFT) is violated for a simple Brownian proce…
Available states and available space: Static properties that predict dynamics of confined fluids
Gaurav Goel, William P. Krekelberg, Mark J. Pond +4
Although density functional theory provides reliable predictions for the static properties of simple fluids under confinement, a theory of comparative accuracy for the transport co…
Density-Dependent Analysis of Nonequilibrium Paths Improves Free Energy Estimates
David D. L. Minh
When a system is driven out of equilibrium by a time-dependent protocol that modifies the Hamiltonian, it follows a nonequilibrium path. Samples of these paths can be used in noneq…
Coarse Nonlinear Dynamics and Metastability of Filling-Emptying Transitions: Water in Carbon Nanotubes
Saravanapriyan Sriraman, Ioannis G. Kevrekidis, Gerhard Hummer
Using a Coarse-grained Molecular Dynamics (CMD) approach we study the apparent nonlinear dynamics of water molecules filling/emptying carbon nanotubes as a function of system param…
Irreversibble Bimolecular Reactions of Langevin Particles
D. J. Bicout, A. M. Berezhkovskii, Attila Szabo
The reaction A+B --> B is studied when the reactants diffuse in phase space, i.e. their dynamics is described by the Langevin equation. The steady-state rate constants are calculat…