화학공학소재연구정보센터

Journal of Chemical Physics

Journal of Chemical Physics, Vol.104, No.11 Entire volume, number list
ISSN: 0021-9606 (Print) 

In this Issue (55 articles)

3865 - 3875 Electronic Spectral Diffusion in Glasses - The Influence of Coupling to the Medium on Experimental Observables
Zimdars D, Fayer MD
3876 - 3885 Midinfrared Spectra of He-Hn2+ and He-2-Hn2+
Meuwly M, Nizkorodov SA, Maier JP, Bieske EJ
3886 - 3897 A Molecular-Dynamics Analysis of Resonance Emission - Optical Dephasing and Inhomogeneous Broadening of CH3I in CH4 and Ar
Fan R, Kalbfleisch T, Ziegler LD
3898 - 3906 Stark-Effect and Dipole-Moments of the Ammonia Dimer in Different Vibration-Rotation-Tunneling States
Cotti G, Linnartz H, Meerts WL, Vanderavoird A, Olthof EH
3907 - 3913 Electronic-Transition Moment and Rotational Transition-Probabilities in CH .2. B-2-Sigma(-)-X(2)Pi System
Luque J, Crosley DR
3914 - 3922 Higher-Order Effects in the Vibration-Torsion-Rotation Spectra of a Molecule with an Internal Rotor
Duan YB, Zhang HM, Takagi K
3923 - 3934 Vibrationally Resolved Photoelectron Angular-Distributions and Branching Ratios for the Carbon-Dioxide Molecule in the Wavelength Region 685-795 Angstrom
West JB, Hayes MA, Siggel MR, Dehmer JL, Dehmer PM, Parr AC, Hardis JE
3935 - 3946 High-Resolution Electronic Spectroscopy of 1-Aminonaphthalene - S-0 and S-1 Geometries and S-1(-S-0 Transition-Moment Orientations
Berden G, Meerts WL, Plusquellic DF, Fujita I, Pratt DW
3947 - 3955 Effects of Different Population, Orientation, and Alignment Relaxation Rates in Resonant 4-Wave-Mixing
Williams S, Rahn LA, Zare RN
3956 - 3961 Calculations of the Low-Temperature Pressure Broadening of Hco+ Rotational Spectral-Lines by H-2
Liao Q, Herbst E
3962 - 3975 Monte-Carlo Simulation of N-Member Associating Fluids - Application to Antigen-Antibody Systems
Busch NA, Wertheim MS, Yarmush ML
3976 - 3988 Guided Ion-Beam Studies of the Reactions of Fe-N(+)(N=2-15) with D-2 - Cluster-Deuteride Bond-Energies as a Chemical Probe of Cluster Structures
Conceicao J, Loh SK, Lian L, Armentrout PB
3989 - 3997 Quantum Chaos in Collinear (He,H-2(+)) Collisions
Mahapatra S, Ramaswamy R, Sathyamurthy N
3998 - 4004 Heterogeneously Catalyzed-Hydrolysis of Chlorine Nitrate - Fourier-Transform Ion-Cyclotron Resonance Investigations of Stratospheric Chemistry
Schindler T, Berg C, Niednerschatteburg G, Bondybey VE
4005 - 4011 A Quantum-Classical Study of the Reaction Co(V(1),J(1))+oh(V(2),J(2))-)Co2+h
Balakrishnan N, Billing GD
4012 - 4018 Reaction of Tungsten Clusters with Molecular Nitrogen
Mitchell SA, Rayner DM, Bartlett T, Hackett PA
4019 - 4030 Photofragment Imaging of Methane
Heck AJ, Zare RN, Chandler DW
4031 - 4040 A Simplified Approach to Optimally Controlled Quantum Dynamics
Botina J, Rabitz H, Rahman N
4041 - 4048 Multidimensional Semiclassical Tunneling Between Asymmetric Wells via 2 Channels
Guo Y, Qin Y, Sorescu DC, Thompson DL
4049 - 4054 Ab-Initio Study of the Ammonia Ion-Ammonia Reaction Paths
Benamor N, Maynau D, Spiegelmann F
4055 - 4060 The (2)Sigma(+) States of Hbeo, Hmgo, and Hcao
Kong J, Boyd RJ
4061 - 4067 On the Accuracy of Valence Correlation Energies in Pseudopotential Calculations
Dolg M
4068 - 4076 State-Specific Coupled Cluster-Type Dressing of Multireference Singles and Doubles Configuration-Interaction Matrix
Meller J, Malrieu JP, Caballol R
4077 - 4082 Ab-Initio Path-Integral Molecular-Dynamics - Basic Ideas
Marx D, Parrinello M
4083 - 4097 Relativistic 4-Component Multiconfigurational Self-Consistent-Field Theory for Molecules - Formalism
Jensen HJ, Dyall KG, Saue T, Faegri K
4098 - 4104 On the Electronic-Structure of the Palladium Monoxide and the Methane Adsorption - Density-Functional Calculations
Broclawik E, Yamauchi R, Endou A, Kubo M, Miyamoto A
4105 - 4113 Bifurcation in Rotational Spectra of Nonlinear Ab(2) Molecules
Kozin IN, Pavlichenkov IM
4114 - 4124 Efficient Recursive Computation of Molecular Integrals for Density-Functional Methods
Koster AM
4125 - 4136 Role of Collective Modes in Vibrational Polarizabilities and Hyperpolarizabilities of Polyacetylene and Other Quasi-Linear Polymers
Kirtman B, Champagne B, Andre JM
4137 - 4150 The Quadrature Discretization Method (Qdm) in the Solution of the Schrodinger-Equation with Nonclassical Basis Functions
Shizgal BD, Chen H
4151 - 4156 Computation of Electron-Affinities of O and F Atoms, and Energy Profile of F-Hp2 Reaction by Density-Functional Theory and Ab-Initio Methods
Jursic BS
4157 - 4165 The Integral-Direct Coupled-Cluster Singles and Doubles Model
Koch H, Demeras AS, Helgaker T, Christiansen O
4166 - 4172 A Kohn-SHAM Study of CH4, C6H6, and O-3 Using Functionals Incorporating Exact Exchange
Tozer DJ
4173 - 4179 An Efficient Fast-Multipole Algorithm-Based on an Expansion in the Solid Harmonics
Wang HY, Lesar R
4180 - 4188 Phase-Stability of Binary Nonadditive Hard-Sphere Mixtures - A Self-Consistent Integral-Equation Study
Lomba E, Alvarez M, Lee LL, Almarza NG
4189 - 4197 A Novel Method for Simulating Quantum Dissipative Systems
Cao JS, Ungar LW, Voth GA
4198 - 4203 Pressure and Light Effects on the Phase-Transition of Deuterated Cu(2,5-Dimethyl-Dicyanoquinonediimine)(2)
Gomez D, Schmitt H, Vonschutz JU, Wachtel H, Wolf HC
4204 - 4213 Exact Affinity Distributions for Linear Polyampholytes and Polyelectrolytes
Koper GJ, Borkovec M
4214 - 4222 Simple One-Particle Diffusional Model to Mimic Some Properties of the Glass-Transition
Ivanov VA, Jung B, Semenov AN, Nyrkova IA, Khokhlov AR
4223 - 4232 Proton Dynamics in Supercooled Water by Molecular-Dynamics Simulations and Quasi-Elastic Neutron-Scattering
Dicola D, Deriu A, Sampoli M, Torcini A
4233 - 4242 Density-Functional Theory of Crystal-Growth - Lennard-Jones Fluids
Shen YC, Oxtoby DW
4243 - 4257 Solvent Effect on Conformational Equilibrium - A Monte-Carlo Study of 1,2-Dichloroethane in Carbon-Tetrachloride
Vilaseca E
4258 - 4266 Charge Stabilization by Chloromethane Molecules on Multilayer Kr Films
Bass AD, Gamache J, Ayotte P, Sanche L
4267 - 4273 Subpicosecond Photoinduced Electron-Transfer from Conjugated Polymers to Functionalized Fullerenes
Kraabel B, Hummelen JC, Vacar D, Moses D, Sariciftci NS, Heeger AJ, Wudl F
4274 - 4282 State-Resolved Probe of an Energetic Surface-Reaction - Phosgene on Silver
Xin QS, Zhu XY
4283 - 4293 A Molecular-Beam Investigation into the Dynamics and Kinetics of Dissociative O-2 Adsorption on Pt(100)-(1X1)
Bradley JM, Guo XC, Hopkinson A, King DA
4294 - 4300 The Dynamics of Matrix Trapping .1. Deposition of a Pure Argon Matrix
Cruz AJ, Lopez GE
4301 - 4308 The Dynamics of Matrix Trapping .2. Simple Spherical Species Trapped in an Argon Matrix
Cruz AJ, Lopez GE
4309 - 4312 Microscopic Simulation of Phase-Transition in Interacting Ionic Gels
Aalberts DP
4313 - 4323 A Surface-Enhanced Hyper-Raman and Surface-Enhanced Raman-Scattering Study of Trans-1,2-bis(4-Pyridyl)Ethylene Adsorbed Onto Silver Film over Nanosphere Electrodes - Vibrational Assignments - Experiment and Theory
Yang WH, Hulteen J, Schatz GC, Vanduyne RP
4324 - 4329 Molecular-Reorientation in Ortho-Carborane Studied by Dielectric-Spectroscopy
Lunkenheimer P, Loidl A
4330 - 4336 Direct Subsurface Absorption of Hydrogen on Pd(III)
Lovvik OM, Olsen RA
4337 - 4342 Microshock Wave-Propagation in Molecular Clusters
Schek I, Jortner J
4343 - 4346 Helix Uncoiling Modes of Sheared Cholesteric Liquid-Crystals
Rey AD
4347 - 4350 Statistical Properties of Resonance States in a Double Morse Potential Well
Dallwig S, Weese I, Weiss T, Schlier C