화학공학소재연구정보센터

Journal of Chemical Physics

Journal of Chemical Physics, Vol.102, No.2 Entire volume, number list
ISSN: 0021-9606 (Print) 

In this Issue (57 articles)

623 - 632 Torsion-Inversion Coupling in the S-1 State of Acetaldehyde
Weersink RA, Cramb DT, Wallace SC, Gordon RD
633 - 642 Cavity Ring-Down Overtone Spectroscopy of HCN, (HCN)-C-13 and (HCN)-N-15
Romanini D, Lehmann KK
643 - 652 Experimental-Determination of Dipole-Moments, Hyperfine Interactions, and Ab-Initio Predictions for Ptn
Jung KY, Steimle TC, Dai D, Balasubramanian K
653 - 659 The Intermolecular Dynamics of Liquid Water
Castner EW, Chang YJ, Chu YC, Walrafen GE
660 - 665 Photoelectron-Spectroscopy of Alns1(-) Clusters (N=1-9)
Nakajima A, Taguwa T, Nakao K, Hoshino K, Iwata S, Kaya K
666 - 674 Ni-2 Revisited - Reassignment of the Ground Electronic-State
Pinegar JC, Langenberg JD, Arrington CA, Spain EM, Morse MD
675 - 679 Overtone Spectroscopy of the Hydroxyl Stretch Vibration in Hydroxylamine (Nh2Oh)
Scott JL, Luckhaus D, Brown SS, Crim FF
680 - 689 Photoionization Spectroscopy of Small Mercury Clusters in the Energy-Range from Vacuum-Ultraviolet to Soft-X-Ray
Blanc J, Broyer M, Dugourd P, Labastie P, Sence M, Wolf JP, Woste L
690 - 701 Ozone Generation Through Photolysis of an Oxygen Matrix at 11-K - Fourier-Transform Infrared-Spectroscopy Identification of the O...O-3 Complex and Isotopic Studies
Schrivermazzuoli L, Desaxce A, Lugez C, Camypeyret C, Schriver A
702 - 707 Internuclear Distance Measurements in Solid-State Nuclear-Magnetic-Resonance - Dipolar Recoupling via Rotor Synchronized Spin Locking
Sun BQ, Costa PR, Kocisko D, Lansbury PT, Griffin RG
708 - 715 Spin-Orbit Interaction Between C-(3)Sigma(+) and B-(1)Pi States of SCF - Effects on the Fine and Hyperfine Structures
Lebeaultdorget MA, Effantin C, Dincan J, Bernard A, Shenyavskaya EA, Verges J
716 - 721 Effects of Temperature and Optical Heating on the Optical-Spectra of Metalloporphyrins in the Vapor-Phase
Davis W, Calongne S, Rodriguez J
722 - 725 Photoionization of Hydrogen and Deuterium
Latimer CJ, Dunn KF, Oneill FP, Macdonald MA, Kouchi N
726 - 743 Laser Sputtering of Highly Oriented Pyrolytic-Graphite at 248-nm
Krajnovich DJ
744 - 753 State-Selected Ion-Molecule Reactions - Charge-Transfer and Atomic Rearrangement Processes in Thermal-Energy Collisions of H-2(+)(X-V)+n-2 and of N-2(+)(X,A-V)+h-2
Uiterwaal CJ, Vaneck J, Niehaus A
754 - 762 Potential-Energy Surface for Carbon-Dioxide Activation by V+ - A Guided Ion-Beam Study
Sievers MR, Armentrout PB
763 - 769 Coulombic Fission and Evaporation of Antimony Cluster Ions
Brechignac C, Cahuzac P, Carlier F, Defrutos M, Leygnier J, Roux JP
770 - 773 Electron-Impact Ionization of the So Free-Radical
Tarnovsky V, Levin A, Deutsch H, Becker K
774 - 783 Global Potential-Energy Surfaces for the Lowest (1)A’, (3)A", and (1)A" States of Hno
Guadagnini R, Schatz GC, Walch SP
784 - 791 Quasi-Classical Trajectory Studies of N+oh, O+nh, and H+no Collisions Using Global Ab-Initio Potential-Energy Surfaces
Guadagnini R, Schatz GC, Walch SP
792 - 798 Photodissociation Dynamics of the Methyl Radical 3S Rydberg State
North SW, Blank DA, Chu PM, Lee YT
799 - 807 Conditional Variation in the Kinetic-Parameters of Rare-Gas Halide Excimers
Datsyuk VV
808 - 814 Atomic Photofragment V-J Correlation - Dissociation of Cl-2 at 355Nm
Wang YF, Loock HP, Cao JY, Qian CX
815 - 827 Effects of Excitation Migration and Translational Diffusion in the Luminescence Quenching Dynamics
Jang SJ, Shin KJ, Lee SY
828 - 832 Diffusion Effects in Stationary Chemical Production-Annihilation Processes
Schulz M, Reineker P
833 - 838 Nonadiabatic Effects in Avoided Crossings of Electronic Potentials - An Application of the Generator-Coordinate Approximation
Broeckhove J, Keutgens W, Lathouwers L, Vanleuven P
839 - 849 Structures, Energetics, and Spectra of Aqua-Sodium(I) - Thermodynamic Effects and Nonadditive Interactions
Kim JS, Lee S, Cho SJ, Mhin BJ, Kim KS
850 - 858 Unrestricted Compact Model Potentials for Ab-Initio Embedded-Cluster Calculations - Magnetic-Interactions in Knif3
Mejias JA, Sanz JF
859 - 871 Integrating the Car-Parrinello Equations .3. Techniques for Ultrasoft Pseudopotentials
Hutter J, Tuckerman M, Parrinello M
872 - 878 On the Accuracy of Gradient-Corrected Density-Functional Methods for Transition-Metal Complexes
Eriksson LA, Pettersson LG, Siegbahn PE, Wahlgren U
879 - 887 Ionic and Covalent Electronic States for K-Adsorbed on Cu-5 and Cu-25 Cluster-Models of the Cu(100) Surface
Bagus PS, Pacchioni G
888 - 897 2nd-Order Correlation-Energy for H2O Using Explicitly Correlated Gaussian Geminals
Bukowski R, Jeziorski B, Rybak S, Szalewicz K
898 - 904 Breaking Bonds with the State-Selective Multireference Coupled-Cluster Method Employing the Single-Reference Formalism
Piecuch P, Adamowicz L
905 - 912 Spin-Orbit Induced Radiationless Transitions in Organometallics - Quantum Simulation of the (1)E-)(3)A(1) Intersystem Crossing Process in Hco(Co)(4)
Daniel C, Heitz MC, Manz J, Ribbing C
913 - 924 Ion-Induced Nucleation - A Density-Functional Approach
Kusaka I, Wang ZG, Seinfeld JH
925 - 931 Alternative Hamiltonian for Molecular-Dynamics Simulations in the Grand-Canonical Ensemble
Lo CM, Palmer B
932 - 938 Simulation Studies of Shear Viscosity Time-Correlation-Functions
Stassen H, Steele WA
939 - 946 The Gas, Liquid, and Solid-Phases of Dimerizing Hard-Spheres and Hard-Sphere Dumbbells
Sear RP, Jackson G
947 - 955 Dipolar Interactions in Magnetically Very Diluted Spin Networks
Lacelle S, Tremblay L
956 - 962 Melting of Neon Clusters - Path-Integral Monte-Carlo Simulations
Chakravarty C
963 - 967 Experimental Transverse Diffusion and Monte-Carlo Simulation Studies of Rb+ Swarm Drifting in He Gas
Ong PP, Tan TL
968 - 974 Phase-Transitions and Chemical-Transformations of Nitromethane Up to 350-Degrees-C and 35-GPa
Courtecuisse S, Cansell F, Fabre D, Petitet JP
975 - 991 Dressed Ion Theory for Bulk Symmetrical Electrolytes in the Restricted Primitive Model
Ennis J, Kjellander R, Mitchell DJ
992 - 1002 Hydrogen on Polycrystalline Diamond Films - Studies of Isothermal Desorption and Atomic Deuterium Abstraction
Koleske DD, Gates SM, Thoms BD, Russell JN, Butler JE
1003 - 1013 Theoretical and Simulation Studies of Recombinative Temperature-Programmed Desorption
Meng B, Weinberg WH
1014 - 1023 Monte-Carlo Simulations of Phase-Equilibria for a Lattice Homopolymer Model
Mackie AD, Panagiotopoulos AZ, Kumar SK
1024 - 1033 Structure of the Metal-Electrolyte Solution Interface - Theoretical Results for Simple-Models
Berard DR, Kinoshita M, Ye X, Patey GN
1034 - 1043 Temperature-Programmed Desorption of Molecular-Hydrogen from a Si(III) Surface - Theory and Experiment
Flowers MC, Jonathan NB, Liu Y, Morris A
1044 - 1056 Si Adatom Binding and Diffusion on the Si(100) Surface - Comparison of Ab-Initio, Semiempirical and Empirical Potential Results
Smith AP, Wiggs JK, Jonsson H, Yan H, Corrales LR, Nachtigall P, Jordan KD
1057 - 1073 Molecular-Dynamics Study of Transport-Coefficients for Hard-Chain Fluids
Smith SW, Hall CK, Freeman BD
1074 - 1077 An Efficient Method of Generating Dense Polymer Model Melts by Computer-Simulation
Gao JP
1078 - 1093 Flat Surface Study of the Eley-Rideal Dynamics of Recombinative Desorption of Hydrogen on a Metal-Surface
Persson M, Jackson B
1094 - 1095 On the Variation of the Interfacial-Tension with Cluster-Size in Connection to Homogeneous Nucleation from the Vapor-Phase
Kegel WK
1096 - 1097 On the Equilibrium Bond-Length of Ammonia in the First Excited Singlet-State
Stanton JF, Kadagathur NS
1098 - 1099 Effect of Substrate Potential Strength on the Melting Temperature of a Hexane Monolayer Adsorbed on Graphite
Velasco E, Peters GH
1100 - 1101 Determination of the CC Bond-Dissociation Energy in Cyanogen
Francisco JS, Richardson SL
1102 - 1102 Integral Cross-Sections and Rate Constants for the Reaction Oh+h-2-)H2O+h - A Semiclassical Wave-Packet Approach (Vol 101, Pg 2785, 1994)
Balakrishnan N, Billing GD