화학공학소재연구정보센터

Journal of Physical Chemistry B

Journal of Physical Chemistry B, Vol.109, No.14 Entire volume, number list
ISSN: 1520-6106 (Print) 

In this Issue (56 articles)

6457 - 6457 Tribute to David Chandler
Chakraborty AK, Miller WH, Schweizer KS
6459 - 6464 Autobiography of David Chandler
Chandler D
6473 - 6478 Electronic states at the water/air interface
Rodriguez J, Laria D
6479 - 6484 Coarse master equation from Bayesian analysis of replica molecular dynamics simulations
Sriraman S, Kevrekidis LG, Hummer G
6485 - 6490 Diffusion coefficients in ionic liquids: Relationship to the viscosity
Brookes R, Davies A, Ketwaroo G, Madden PA
6491 - 6499 Optimal choice of dividing surface for the computation of quantum reaction rates
Predescu C, Miller WH
6500 - 6504 Anisotropic interfacial free energies of the hard-sphere crystal-melt interfaces
Mu Y, Houk A, Song XY
6505 - 6513 Kinetic theory derivation of the transport coefficients of stochastic rotation dynamics
Pooley CM, Yeomans JM
6514 - 6519 Ultrafast to slow orientational dynamics of a homeotropically aligned nematic liquid crystal
Li J, Wang I, Fayer MD
6520 - 6526 Nucleation in hydrophobic cylindrical pores: A lattice model
Saugey A, Bocquet L, Barrat JL
6527 - 6534 Computational investigation of order, structure, and dynamics in modified water models
Lynden-Bell RM, Debenedetti PG
6535 - 6543 A dendronized polymer is a single-molecule glass
Das JJ, Yoshida M, Fresco ZA, Choi TL, Frechet JMJ, Chakraborty AK
6544 - 6552 Unmixing of polymer blends confined in ultrathin films: Crossover between two-dimensional and three-dimensional behavior
Cavallo A, Muller M, Binder K
6553 - 6563 Phase behavior of model lipid bilayers
Kranenburg M, Smit B
6564 - 6572 Local quantum critical point in the pseudogap Anderson model: Finite-T dynamics and omega/T scaling
Glossop MT, Jones GE, Logan DE
6573 - 6586 Effective force field for liquid hydrogen fluoride from ab initio molecular dynamics simulation using the force-matching method
Izvekov S, Voth GA
6587 - 6594 Stresses inside critical nuclei
Cacciuto A, Frenkel D
6595 - 6603 Thermodynamics, orientational order and elasticity of strained liquid crystalline melts and elastomers
Oyerokun FT, Schweizer KS
6604 - 6609 Alternative view of self-diffusion and shear viscosity
Stillinger FH, Debenedetti PG
6610 - 6619 A theoretical investigation of charge transfer in several substituted acridinium ions
Lappe J, Cave RJ, Newton MD, Rostov IV
6620 - 6628 Density functional theory of realistic models of polyethylene liquids in slit pores: Comparison with Monte Carlo simulations
Nath SK, Curro JG, McCoy JD
6629 - 6635 Water between plates in the presence of an electric field in an open system
Vaitheeswaran S, Yin H, Rasaiah JC
6636 - 6639 Correlation and cross-linking effects in imprinting sites for divalent adsorption in gels
Stancil KA, Feld MS, Kardar M
6640 - 6649 Density-functional study of interfacial properties of colloid-polymer mixtures
Moncho-Jorda A, Dzubiella J, Hansen JP, Louis AA
6650 - 6657 Accurate free energies of micelle formation
Pool R, Bolhuis PG
6658 - 6665 Partial molar volume of proteins studied by the three-dimensional reference interaction site model theory
Imai T, Kovalenko A, Hirata F
6666 - 6675 Mode coupling and dynamical heterogeneity in colloidal gelation: A simulation study
Puertas AM, Fuchs M, Cates ME
6676 - 6687 A recipe for the computation of the free energy barrier and the lowest free energy path of concerted reactions
Ensing B, Laio A, Parrinello M, Klein ML
6688 - 6693 Finite temperature string method for the study of rare events
Weinan E, Ren WQ, Vanden-Eijnden E
6694 - 6700 Introducing variable cell shape methods in field theory simulations of polymers
Barrat JL, Fredrickson GH, Sides SW
6701 - 6704 Markov chains of infinite order and asymptotic satisfaction of balance: Application to the adaptive integration method
Earl DJ, Deem MW
6705 - 6713 Molecular dynamics study of hydration in ethanol-water mixtures using a polarizable force field
Noskov SY, Lamoureux G, Roux B
6714 - 6721 Assessing the accuracy of metadynamics
Laio A, Rodriguez-Fortea A, Gervasio FL, Ceccarelli M, Parrinello M
6722 - 6731 Temperature weighted histogram analysis method, replica exchange, and transition paths
Gallicchio E, Andrec M, Felts AK, Levy RM
6732 - 6740 Solvation dynamics in reverse micelles: The role of headgroup-solute interactions
Faeder J, Ladanyi BM
6741 - 6747 Self-assembly of nanoparticles in three-dimensions: Formation of stalagmites
Sztrum CG, Hod O, Rabani E
6748 - 6753 Examination of dynamic facilitation in molecular dynamics simulations of glass-forming liquids
Bergroth MNJ, Vogel M, Glotzer SC
6754 - 6763 Density functional theory of solvation and its relation to implicit solvent models
Ramirez R, Borgis D
6764 - 6768 Integral equation theory for symmetric nonadditive hard sphere mixtures
Jagannathan K, Reddy G, Yethiraj A
6769 - 6779 Automatic method for identifying reaction coordinates in complex systems
Ma A, Dinner AR
6780 - 6786 One-dimensional reaction coordinate and the corresponding potential of mean force from commitment probability distribution
Rhee YM, Pande VS
6787 - 6792 Resonant nonequilibrium temperatures
Ritort F
6793 - 6804 Ab initio molecular dynamics simulation of the aqueous Ru2+/Ru3+ redox reaction: The Marcus perspective
Blumberger J, Sprik M
6805 - 6811 Practical applicability of the Jarzynski relation in statistical mechanics: A pedagogical example
Lua RC, Grosberg AY
6812 - 6823 Chemical models of genetic toggle switches
Warren PB, ten Wolde PR
6824 - 6837 Convergence of fine-lattice discretization for near-critical fluids
Moghaddam S, Kim YC, Fisher ME
6838 - 6844 Assisted adiabatic passage revisited
Demirplak M, Rice SA
6845 - 6848 Fluorophore-quencher distance correlation functions from single-molecule photon arrival trajectories
Gopich I, Szabo A
6849 - 6854 Local mean field models of uniform to nonuniform density fluid-crystal transitions
Butta P, Lebowitz JL
6855 - 6865 An adiabatic linearized path integral approach for quantum time functions: Electronic transport in metal-molten salt solutions
Causo MS, Ciccotti G, Montemayor D, Bonella S, Coker DF
6866 - 6878 Solvation thermodynamics: Theory and applications
Ben-Amotz D, Raineri FO, Stell G
6879 - 6883 A mode-coupling theory of vibrational line broadening in near-critical fluids
Egorov SA, Lawrence CP, Skinner JL
6884 - 6891 Dynamics of amide-I modes of the alanine dipeptide in D2O
Kim YS, Hochstrasser RM
6892 - 6901 Structure of nonuniform hard sphere fluids from shifted linear truncations of functional expansions
Chen YG, Weeks JD
6902 - 6915 Biased sampling of nonequilibrium trajectories: Can fast switching simulations outperform conventional free energy calculation methods?
Oberhofer H, Dellago C, Geissler PL
6916 - 6916 Numerical study of a fragile three-dimensional kinetically constrained model (vol 109, pg 3578, 2005)
Berthier L, Garrahan JP