화학공학소재연구정보센터

Journal of Chemical Physics

Journal of Chemical Physics, Vol.106, No.12 Entire volume, number list
ISSN: 0021-9606 (Print) 

In this Issue (52 articles)

4823 - 4831 Rotational Analysis and Assignment of the Green Band System of Feh to the E-(6)Pi-A-(6)Delta Transition
Goodridge DM, Carter RT, Brown JM, Steimle TC
4832 - 4839 Semiclassical Dynamics in Up to 15 Coupled Vibrational Degrees of Freedom
Brewer ML, Hulme JS, Manolopoulos DE
4840 - 4852 Temperature-Dependence of Optical Dephasing in an Organic Polymer Glass (PMMA) from 300 K to 30 K
Nagasawa Y, Passino SA, Joo T, Fleming GR
4853 - 4859 Photoabsorption and Fluorescence Cross-Sections of Sicl4 in the Region of 6.2-31 eV
Ibuki T, Kono M, Asari Y, Hiraya A, Shobatake K
4860 - 4868 A High-Resolution Analysis of the (C)over-Tilde(2)A(1)-(X)over-Tilde(2)A(1) Transition of Canh2 - Pure Precession in Polyatomic-Molecules
Morbi Z, Zhao CF, Bernath PF
4869 - 4876 High-Resolution Laser Spectroscopy of the Cs-2-C-(1)Pi(U) State - Perturbation and Predissociation
Kasahara S, Hasui Y, Otsuka K, Baba M, Demtroder W, Kato H
4877 - 4888 The Vibrational-Spectrum of H2O2+ Radical-Cation - An Illustration of Symmetry-Breaking
Hrusak J, Iwata S
4889 - 4893 3rd-Order Nonlinear Response of Liquid Water
Saito S, Ohmine I
4894 - 4901 Jet Spectroscopy of P-Methoxyaniline and Intramolecular Vibrational-Relaxation Dynamics in the P-Alkoxyaniline Series
Wategaonkar S, Doraiswamy S
4902 - 4911 2-Dimensional Photoelectron-Spectroscopy of Acetylene - Rydberg-Valence Interaction Between the (3-Sigma(G))(-1)(3P-Sigma(U))(1) and (3-Sigma(G))(-1)(3-Sigma(U))(1) States
Hattori H, Hikosaka Y, Hikida T, Mitsuke K
4912 - 4917 Transition-State Barrier Height for the Reaction H2CO-)H-2+co Studied by Multireference Moller-Plesset Perturbation-Theory
Nakano H, Nakayama K, Hirao K, Dupuis M
4918 - 4930 Semiclassical-Limit Molecular-Dynamics on Multiple Electronic Surfaces
Martens CC, Fang JY
4931 - 4944 The Vibrational Deactivation of Co(V=1) by Inelastic-Collisions with H-2 and D-2
Reid JP, Simpson CJ, Quiney HM
4945 - 4953 Crossed-Beam Reaction of Carbon-Atoms with Hydrocarbon Molecules .4. Chemical-Dynamics of Methylpropargyl Radical Formation, C4H5, from Reaction of C(P-3(J)) with Propylene, C3H6 (X(1)A’)
Kaiser RI, Stranges D, Bevsek HM, Lee YT, Suits AG
4954 - 4962 An Effective Transition-State for a Complex Cluster Isomerization Process - Comparison Between Anharmonic and Harmonic Models for Mg+ar12
Fanourgakis GS, Farantos SC, Parneix P, Brechignac P
4963 - 4972 Resonance Raman-Study of Solvent Dynamics in Electron-Transfer .1. Betaine-30 in CH3CN and Cd3Cn
Zong YP, Mchale JL
4973 - 4984 Fragmentation of Isolated Ions by Multiple-Photon Absorption - A Quantitative Study
Boissel P, Deparseval P, Marty P, Lefevre G
4985 - 4991 Nascent Rotational and Vibrational-State Distributions of NH(X (3)Sigma(-)) and Nd(X (3)Sigma(-)) Produced in the Reactions of N(2 D-2) with H-2 and D-2
Umemoto H, Asai T, Kimura Y
4992 - 5005 Density-Dependence of the Collisional Deactivation of Highly Vibrationally Excited Cycloheptatriene in Compressed Gases, Supercritical Fluids, and Liquids
Benzler J, Linkersdorfer S, Luther K
5006 - 5012 Separation of Time Scales in Species Conversion by Diffusion-Controlled Reactions in a Binary Suspension of Spheres
Felderhof BU, Jones RB
5013 - 5027 Oriented Molecule Photoelectron Angular-Distributions in the Vicinity of a Photoionization Shape Resonance - Continuum Multiple Scattering-X-Alpha Calculations for Valence Ionization of Cf3Cl
Powis I
5028 - 5042 Dynamics of Oh and OD Radical Reactions with HI and GeH4 as Studied by Infrared Chemiluminescence of the H2O and HDO Products
Butkovskaya NI, Setser DW
5043 - 5048 Correlation Formula for the Couplings at Crossings Between Ionic and Covalent Molecular-States
Aquilanti V, Cappelletti D, Pirani F
5049 - 5061 Diffusion-Influenced Reversible Transfer of Electronic Excitation-Energy in Liquid Solution by Long-Range Interaction
Bandyopadhyay T
5062 - 5072 Detecting Wave-Packet Motion in Pump-Probe Experiments - Theoretical-Analysis
Cao JS, Wilson KR
5073 - 5084 Pseudospectral Localized Generalized Moller-Plesset Methods with a Generalized Valence-Bond Reference Wave-Function - Theory and Calculation of Conformational Energies
Murphy RB, Pollard WT, Friesner RA
5085 - 5090 A Low-Storage Filter Diagonalization Method for Quantum Eigenenergy Calculation or for Spectral-Analysis of Time Signals
Mandelshtam VA, Taylor HS
5091 - 5101 Density-Functional Results for Isotropic and Anisotropic Multipole Polarizabilities and C-6, C-7, and C-8 Van-der-Waals Dispersion Coefficients for Molecules
Osinga VP, Vangisbergen SJ, Snijders JG, Baerends EJ
5102 - 5108 The Hydroperoxyl Radical Dimer - Triplet Ring or Singlet String
Fermann JT, Hoffman BC, Tschumper GS, Schaefer HF
5109 - 5122 Helium Dimer Potential from Symmetry-Adapted Perturbation-Theory Calculations Using Large Gaussian Geminal and Orbital Basis-Sets
Korona T, Williams HL, Bukowski R, Jeziorski B, Szalewicz K
5123 - 5132 Coupled-Cluster Spectroscopic Properties and Isomerization Pathway for the Cyanate/Fulminate Isomer Pair, Nco-/CNO-
Pak Y, Woods RC, Peterson KA
5133 - 5142 Ab-Initio Relativistic Effective Potentials with Spin-Orbit Operators .7. Am Through Element-118
Nash CS, Bursten BE, Ermler WC
5143 - 5150 The Torsional Conformations of Butane - Definitive Energetics from Ab-Initio Methods
Allinger NL, Fermann JT, Allen WD, Schaefer HF
5151 - 5158 Continuum Solvation Models - A New Approach to the Problem of Solutes Charge-Distribution and Cavity Boundaries
Mennucci B, Tomasi J
5159 - 5170 Theory of Solvent Effects on Electronic Absorption-Spectra of Rodlike or Disk-Like Solute Molecules - Frequency-Shifts
Nagae H
5171 - 5180 The Conformation of Hard-Sphere Polymers in Hard-Sphere Solution Calculated by Single-Chain Simulation in a Many-Body Solvent Influence Functional
Grayce CJ
5181 - 5188 Collapse of a Ring Polymer - Comparison of Monte-Carlo and Born-Green-Yvon Integral-Equation Results
Taylor MP, Mar JL, Lipson JE
5189 - 5201 From Clusters to Bulk - A Relativistic Density-Functional Investigation on a Series of Gold Clusters Au-N, N=6,...,147
Haberlen OD, Chung SC, Stener M, Rosch N
5202 - 5215 Analysis of Salt Effects on Solubility of Noble-Gases in Water Using the Reference Interaction Site Model-Theory
Kinoshita M, Hirata F
5216 - 5224 Distributed Approximating Functional-Approach to the Fokker-Planck Equation - Eigenfunction Expansion
Zhang DS, Wei GW, Kouri DJ, Hoffman DK
5225 - 5238 Nonlinear Electrical Potential Fluctuations of Solvent Around Solutes - An Integral-Equation Study
Chong SH, Hirata F
5239 - 5248 Quantum Control of Dissipative Systems - Exact-Solutions
Cao JS, Messina M, Wilson KR
5249 - 5253 Self-Assembled Molecular Rectifiers
Dhirani A, Lin PH, Guyotsionnest P, Zehner RW, Sita LR
5254 - 5259 Polar CdSe Nanocrystals - Implications for Electronic-Structure
Schmidt ME, Blanton SA, Hines MA, Guyotsionnest P
5260 - 5270 A Diffusion Process-Controlled Monte-Carlo Method for Finding the Global Energy Minimum of a Polypeptide-Chain .1. Formulation and Test on a Hexadecapeptide
Derreumaux P
5271 - 5283 Experimental and Theoretical-Studies of the Monolayer Structure of OCS Adsorbed on NaCl(001) - Coexistence of Orientationally Inequivalent Phases
Picaud S, Girardet C, Glebov A, Toennies JP, Dohrmann J, Weiss H
5284 - 5287 Interfacial Curvature Free-Energy, the Kelvin Relation, and Vapor-Liquid Nucleation Rate
Mcgraw R, Laaksonen A
5288 - 5291 Crossed-Beam Reaction of Atomic Carbon C(P-3(J)) with Hydrogen-Sulfide, H2S(X(1)A(1)) - Observation of the Thioformyl Radical, Hcs(X(2)A’)
Kaiser RI, Sun W, Suits AG
5292 - 5295 Detection of Metastable Triplet Acetylene Produced by Intersystem Crossing from the Excited A((1)A(U)) State
Suzuki T, Shi Y, Kohguchi H
5296 - 5296 Relaxation of Collective Excitations in LJ-13 Cluster - Comment
Wales DJ, Doye JP
5297 - 5297 Relaxation of Collective Excitations in LJ-13 Cluster - Response
Salian UA, Behera SN, Ramamurthy VS
5298 - 5299 Time-Resolved Laser-Induced Harpoon Reactions
Apkarian VA