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The Journal of Chemical Physics|April 20, 2005
Surface enrichment of branched polymers in linear hosts: effect of asymmetry in intersegmental interactions and density gradientsVenkatachala S Minnikanti, Lynden A ArcherThe Journal of Chemical Physics|April 20, 2005
Comment on "First principles electrochemistry: electrons and protons reacting as independent ions" [J. Chem. Phys. 117, 10193 (2002)]Alan L RockwoodThe Journal of Chemical Physics|April 20, 2005
Accelerating quantum mechanical/molecular mechanical sampling using pure molecular mechanical potential as an importance function: the case of effective fragment potentialPradipta BandyopadhyayThe Journal of Chemical Physics|April 20, 2005
Dynamics of coupled Bohmian and phase-space variables: a moment approach to mixed quantum-classical dynamicsIrene BurghardtThe Journal of Chemical Physics|April 20, 2005
Electron correlation in Hooke's law atom in the high-density limitP M W Gill, D P O'NeillThe Journal of Chemical Physics|April 20, 2005
Local-MP2 electron correlation method for nonconducting crystalsC Pisani, M Busso, G Capecchi, et al.The Journal of Chemical Physics|April 20, 2005
Structures of [(CO2)n(H2O)m]- (n=1-4, m=1,2) cluster anions. I. Infrared photodissociation spectroscopyAzusa Muraoka, Yoshiya Inokuchi, Nobuyuki Nishi, et al.The Journal of Chemical Physics|April 20, 2005
Structure and energetics of small gold nanoclusters and their positive ionsA V WalkerThe Journal of Chemical Physics|April 20, 2005
Photoisomerization of azobenzene from first-principles constrained density-functional calculationsMurilo L Tiago, Sohrab Ismail-Beigi, Steven G LouieThe Journal of Chemical Physics|April 20, 2005
Mutual orientation of two C60 molecules: an ab initio studyFlorent Tournus, Jean-Christophe Charlier, Patrice MélinonPageof 5,306