화학공학소재연구정보센터

Journal of Chemical Physics

Journal of Chemical Physics, Vol.104, No.12 Entire volume, number list
ISSN: 0021-9606 (Print) 

In this Issue (56 articles)

4357 - 4364 High Rydberg States of Dabco - Spectroscopy, Ionization-Potential, and Comparison with Mass-Analyzed Threshold Ionization
Boogaarts MG, Holleman I, Jongma RT, Parker DH, Meijer G, Even U
4365 - 4370 High-Resolution Infrared Study of the Translational Lattice Modes in Alpha-N-2 Single-Crystals
Bini R
4371 - 4379 Fluorescence-Line-Narrowing Spectroscopy of Nile Blue in Glass and Polymer at 5 K - Determination of a Single-Site Line-Shape Function
Zhang YP, Hartmann SR, Moshary F
4380 - 4389 Incoherent 4-Wave-Mixing on Nile Blue and Cresyl Violet in Glass and Polymer at 5 K - Single-Site Line-Shape Analysis
Zhang YP, Hartmann SR, Moshary F
4390 - 4395 Transient Absorption-Spectra and Bleaching of 4’-N-Pentyl-4-Cyanoterphenyl in Cyclohexane - Determination of Cross-Sections and Recovery Times
Sander R, Herrmann V, Menzel R
4396 - 4405 Structural Relaxations in H-2-Substituted Myoglobin Observed by Temperature-Cycling Hole-Burning
Shibata Y, Kurita A, Kushida T
4406 - 4410 Resonance-Enhanced Multiphoton Ionization Spectroscopy of the Snf Radical
Pearson J, Dixon RN, Hudgens JW, Johnson RD
4411 - 4418 The Structure and Intermolecular Dynamics of the Nitrous Oxide-Ethylene Complex - Experiment and Ab-Initio Theory
Bemish RJ, Rhee WM, Pedersen LG, Miller RE
4419 - 4426 5th-Order Nonlinear Spectroscopy on the Low-Frequency Modes of Liquid Cs2
Tominaga K, Yoshihara K
4427 - 4433 High-Resolution Fourier-Transform Infrared-Spectroscopy of the Nu(6) and Nu(10) Bands of Jet-Cooled Fe(Co)(5)
Asselin P, Soulard P, Tarrago G, Lacome N, Manceron L
4434 - 4440 Anomalous Impurity Spectra in Low-Temperature Glasses
Kikas J, Suisalu A, Zazubovich V, Vois P
4441 - 4450 Microwave Dielectric Characterization of Binary-Mixtures of Water, Methanol, and Ethanol
Bao JZ, Swicord ML, Davis CC
4451 - 4469 Hindered Internal-Rotation and Torsion-Vibrational Coupling in Ortho-Chlorotoluene (S-1) and Ortho-Chlorotoluene(+) (D-0)
Richard EC, Walker RA, Weisshaar JC
4470 - 4474 Production of I-Asterisk(P-2(1/2)) in the Ultraviolet Photodissociation of Cu-Branched Alkyl Iodides
Uma S, Das PK
4475 - 4480 Auger Decay of the Dissociating Core-Excited States in the HCl and Dcl Molecules
Kukk E, Aksela H, Sairanen OP, Aksela S, Kivimaki A, Nommiste E, Ausmees A, Kikas A, Osborne SJ, Svensson S
4481 - 4489 State-to-State Reaction Dynamics of R+hcn (Nu(1)Nu(L2)(2)Nu(3))-)Rh+cn(V,J) with R+cl,H
Kreher C, Theinl R, Gericke KH
4490 - 4501 Reactions of O, H, and Cl Atoms with Highly Vibrationally Excited HCN - Using Product States to Determine Mechanisms
Pfeiffer JM, Metz RB, Thoemke JD, Woods E, Crim FF
4502 - 4516 Theory and Modeling of Ion-Molecule Radiative Association Kinetics
Klippenstein SJ, Yang YC, Ryzhov V, Dunbar RC
4517 - 4529 Reaction Dynamics of the 4-Centered Elimination Ch2Oh+-)Cho++h-2 - Measurement of Kinetic-Energy Release Distribution and Classical Trajectory Calculation
Lee TG, Park SC, Kim MS
4530 - 4543 Semiclassical Coupled-Wave Packet Study of the Nonadiabatic Collisions Ar+(J)+h-2 - Zero Angular-Momentum Case
Aguillon F, Sizun M, Sidis V, Billing GD, Markovic N
4544 - 4553 A 6 Dimensional Quantum Study for Atom Triatom Reactions - The H+h2O-)H-2+oh Reaction
Zhang DH, Light JC
4554 - 4567 Molecular-Orbital Decomposition of the Ionization Continuum for a Diatomic Molecule by Angle-Resolved and Energy-Resolved Photoelectron-Spectroscopy .1. Formalism
Park H, Zare RN
4568 - 4580 Molecular-Orbital Decomposition of the Ionization Continuum for a Diatomic Molecule by Angle-Resolved and Energy-Resolved Photoelectron-Spectroscopy .2. Ionization Continuum of No
Park H, Zare RN
4581 - 4590 Dynamics of Proton-Transfer in Mesoscopic Clusters
Consta S, Kapral R
4591 - 4599 Photodissociation Spectroscopy of Ca+-H2O and Ca+-D2O
Scurlock CT, Pullins SH, Reddic JE, Duncan MA
4600 - 4610 An Interpolated Unrestricted Hartree-Fock Potential-Energy Surface for the Oh+h-2-)H2O+h Reaction
Jordan MJ, Collins MA
4611 - 4620 Analytical Derivatives for Molecular Solutes .3. Hartree-Fock Static Polarizability and Hyperpolarizabilities in the Polarizable Continuum Model
Cammi R, Cossi M, Tomasi J
4621 - 4631 A Quantum Monte-Carlo Perturbational Study of the He-He Interaction
Huiszoon C, Caffarel M
4632 - 4641 Semiempirical Methodology for Simulating Covalently Bonded Materials - Application to Silicon
Chen A, Corrales LR
4642 - 4651 Relativistic Effects in the Cationic Platinum Carbene Ptch2+
Heinemann C, Schwarz H, Koch W, Dyall KG
4652 - 4656 A Tight-Binding Model for Calculations of Structures and Properties of Graphitic Nanotubes
Molina JM, Savinsky SS, Khokhriakov NV
4657 - 4663 Is There Evidence for Detection of Cyclic C-4 in Ir-Spectra - An Accurate Ab-Initio Computed Quartic Force-Field
Martin JM, Schwenke DW, Lee TJ, Taylor PR
4664 - 4671 General-Method for Removing Resonance Singularities in Quantum-Mechanical Perturbation-Theory
Kuhler KM, Truhlar DG, Isaacson AD
4672 - 4684 Spin-Orbit Configuration-Interaction Study of Potential-Energy Curves and Transition-Probabilities of the Mercury Hydride Molecule and Tests of Relativistic Effective Core Potentials for Hg, Hg+, and Hg2+
Alekseyev AB, Liebermann HP, Buenker RJ, Hirsch G
4685 - 4698 Fast Assembly of the Coulomb Matrix - A Quantum-Chemical Tree Code
Challacombe M, Schwegler E, Almlof J
4699 - 4715 Molecular Quadrupole-Moment Functions of HF and N-2 .1. Ab-Initio Linear-Response Coupled-Cluster Results
Piecuch P, Kondo AE, Spirko V, Paldus J
4716 - 4727 Molecular Quadrupole-Moment Functions of HF and N-2 .2. Rovibrational Effects
Spirko V, Piecuch P, Kondo AE, Paldus J
4728 - 4735 Equation of State for Fluids of Hard Heteronuclear Diatomic and Symmetrical Triatomic-Molecules
Maeso MJ, Solana JR
4736 - 4745 Static and Dynamic Vibrational Dephasing in a Dense Fluid
Schvaneveldt SJ, Loring RF
4746 - 4754 Binding Mean Spherical Approximation for Pairing Ions - An Exponential Approximation and Thermodynamics
Bernard O, Blum L
4755 - 4767 Quantum Molecular-Dynamics Studies of H-2 Transport in Water
Mei HS, Coker DF
4768 - 4775 Calculation of Nuclear-Magnetic-Resonance Order Parameters in Proteins by Normal-Mode Analysis
Sunada S, Go N, Koehl P
4776 - 4783 Quantum Adiabatic Umbrella Sampling - The Excited-State Free-Energy Surface of an Electron-Atom Pair in Solution
Borgis D, Staib A
4784 - 4787 3-Body Interactions in Fluids from Molecular Simulation - Vapor-Liquid Phase Coexistence of Argon
Sadus RJ, Prausnitz JM
4788 - 4801 Monte-Carlo Simulation of Branched and Cross-Linked Polymers
Escobedo FA, Depablo JJ
4802 - 4805 Surface Segregation and Layering in the Liquid-Vapor Interface of a Dilute Bismuth-Gallium Alloy
Lei N, Huang ZQ, Rice SA
4806 - 4813 Molecular-Dynamics Simulation Study of Adsorption of Polymer-Chains with Variable Degree of Rigidity .1. Static Properties
Kramarenko EY, Winkler RG, Khalatur PG, Kohkhlov AR, Reineker P
4814 - 4827 Chain Model of Electrorheology
Martin JE, Anderson RA
4828 - 4834 A Dynamic Rotational Isomeric State Approach for Extension of the Time-Scale of the Local Dynamics Observed in Fully Atomistic Molecular-Dynamics Simulations - Application to Polybutadiene
Haliloglu T, Bahar I, Erman B, Kim EG, Mattice WL
4835 - 4841 Collapse of a Polymer-Chain - A Born-Green-Yvon Integral-Equation Study
Taylor MP, Lipson JE
4842 - 4849 Inert-Gas Scattering from Molten Metals - Probing the Stiffness and Roughness of the Surfaces of Atomic Liquids
Ronk WR, Kowalski DV, Manning M, Nathanson GM
4850 - 4858 On the Determination of Domain Sizes in Polymers by Spin-Diffusion
Wang JH
4859 - 4861 The Identification of the Feh2 Radical in the Gas-Phase by Infrared-Spectroscopy
Korsgen H, Murtz P, Lipus K, Urban W, Towle JP, Brown JM
4862 - 4864 The Oxidation-Induced Formation of Metallocarbohedrene Ions
Deng HT, Kerns KP, Castleman AW
4865 - 4868 Intracluster Reactions - The Formation of Hydrazine Complexes from Ammonia Clusters Following ArF Excimer-Laser Excitation
Farber M, Huisken F
4869 - 4870 Free-Energy as the Potential of Mean Constraint Force
Mulders T, Kruger P, Swegat W, Schlitter J