화학공학소재연구정보센터

Journal of Chemical Physics

Journal of Chemical Physics, Vol.105, No.19 Entire volume, number list
ISSN: 0021-9606 (Print) 

In this Issue (57 articles)

8481 - 8489 Saturation Behavior in Degenerate 4-Wave-Mixing with Nonmonochromatic, Non-Lorentzian Fields
Tang Y, Reid SA
8490 - 8494 Field and Temperature Dependencies of Free-Carrier Photogeneration Efficiencies of Molecular Glasses
Lin LB, Jenekhe SA, Borsenberger PM
8495 - 8501 Rotational Spectra, Structures, and Dynamics of Small Ar-M-(H2O)(N) Clusters - The Ar-2-H2O Trimer
Arunan E, Dykstra CE, Emilsson T, Gutowsky HS
8502 - 8514 An Accurate Modified Kramers-Kronig Transformation from Reflectance to Phase-Shift on Attenuated Total-Reflection
Bertie JE, Lan ZD
8515 - 8522 The Infrared-Spectroscopy and Dynamics of Oco-HCl and Sco-HCl - An Example of Mode-Specific Intermolecular Energy-Transfer
Oudejans L, Olson D, Miller RE
8523 - 8535 On the Interrelation Between Nuclear-Dynamics and Spectral-Line Shapes in Clusters
Heidenreich A, Jortner J
8536 - 8542 The Torsional Spectrum of Ch3Cd3
Moazzenahmadi N, Ozier I, Mckellar AR, Zerbetto F
8543 - 8555 Interplay of Multiple Vibrational Spectral Densities in Femtosecond Nonlinear Spectroscopy of Liquids
Khidekel V, Chernyak V, Mukamel S
8556 - 8568 A Study on the Structure and Vibrations of Diphenylamine by Resonance-Enhanced Multiphoton Ionization Spectroscopy and Ab-Initio Calculations
Boogaarts MG, Vonhelden G, Meijer G
8569 - 8585 On a Theoretical-Model for the Renner-Teller Effect in Tetra-Atomic Molecules
Peric M, Ostojic B, Engels B
8586 - 8601 2-Exciton Spectroscopy of Photosynthetic Antenna Complexes - Collective Oscillator Analysis
Kuhn O, Chernyak V, Mukamel S
8602 - 8614 Microwave Spectroscopy and Interaction Potential of the Long-Range He-Center-Dot-Center-Dot-Center-Dot-Kr+ Ion - An Example of Hunds-Case(E)
Carrington A, Pyne CH, Shaw AM, Taylor SM, Hutson JM, Law MM
8615 - 8627 Resonance Raman-Spectrum of Hocl - A Time-Dependent Quantum Dynamical Treatment
Offer AR, Balintkurti GG
8628 - 8632 Quantum-Mechanical Tunneling Through a Time-Dependent Barrier
Ge JY, Zhang JZ
8633 - 8638 The Influence of Multiple-Scattering Processes on the Electron-Mobility in Low-Density Methanol Gas
Asaad AN, Klahn T, Krebs P
8639 - 8652 Diabatic Approach to the Close-Coupling Wave-Packet Method in Reactive Scattering
Caratzoulas S, Jackson B
8653 - 8660 Born-Oppenheimer Type Separation in the Study of the Dynamics - Application to Photodetachment of Clhcl- and Cldcl-
Rougeau N, Marcotte S, Kubach C
8661 - 8665 Further Study on Collisional Quantum Interference Effect in Energy-Transfer Within Co Singlet-Triplet Mixed States
Chen XL, Sha GH, Jiang B, He JB, Zhang CH
8666 - 8683 Vibrational Frequency-Shift of HF in Helium Clusters - Quantum Simulation and Experiment
Blume D, Lewerenz M, Huisken F, Kaloudis M
8684 - 8689 A Density-Functional Study of the Intermolecular Interactions of Benzene
Meijer EJ, Sprik M
8690 - 8698 Performance of a Time-Independent Scattering Wave-Packet Technique Using Real Operators and Wave-Functions
Kroes GJ, Neuhauser D
8699 - 8704 Effect of Location of Energy Barrier on the Product Alignment of Reaction A+bc
Han KL, He GZ, Lou NQ
8705 - 8720 Crossed-Beam Reaction of Carbon-Atoms with Hydrocarbon Molecules .1. Chemical-Dynamics of the Propargyl Radical Formation C3H3 (X(2)B(2)), from Reaction of C(P-3(J)) with Ethylene, C2H4(X(1)A(G))
Kaiser RI, Lee YT, Suits AG
8721 - 8733 Crossed-Beam Reaction of Carbon-Atoms with Hydrocarbon Molecules .2. Chemical-Dynamics of N-C4H3 Formation from Reaction of C(P-3(J)) with Methylacetylene, Ch3Cch(X(1)A(1))
Kaiser RI, Stranges D, Lee YT, Suits AG
8734 - 8740 Shell Structure and Shapes of Fermion Microsystems - A Comparative-Study of He-3 and Na Clusters
Yannouleas C, Landman U
8741 - 8747 Analytical Derivatives of Atomic Zero-Flux Surfaces and Properties of Atoms in Molecules with Respect to External Perturbations
Cioslowski J, Stefanov BB
8748 - 8753 Ionization Energies of Anthracene, Phenanthrene, and Naphthacene
Zakrzewski VG, Dolgounitcheva O, Ortiz JV
8754 - 8768 Global 3-Dimensional Potential-Energy Surfaces of H2S from the Ab-Initio Effective Valence Shell Hamiltonian Method
Stevens JE, Chaudhuri RK, Freed KF
8769 - 8776 Formulation and Implementation of a Relativistic Unrestricted Coupled-Cluster Method Including Noniterative Connected Triples
Visscher L, Lee TJ, Dyall KG
8777 - 8784 The Symmetry-Breaking Problem in the Triflouride Anion - A Multireference Approach
Mota F, Novoa JJ
8785 - 8792 A Theoretical-Study of the Valence-Bound and Dipole-Bound States of the Nitromethane Anion
Gutsev GL, Bartlett RJ
8793 - 8800 Nuclear-Magnetic-Resonance Spin-Spin Coupling-Constants from Density-Functional Theory - Problems and Results
Malkina OL, Salahub DR, Malkin VG
8801 - 8803 Test of the Equation of State of Water Up to Freezing at 100 and 200-Degrees-C
Grimsditch M, Popova S, Polian A
8804 - 8821 Asymptotic Solution and Numerical-Simulation of Homogeneous Condensation in Expansion Cloud Chambers
Delale CF, Muitjens MJ, Vandongen ME
8822 - 8825 Model for Slow Relaxation in Supercooled Liquids
Das SP
8826 - 8834 Molecular-Dynamics Study of Na+ and Cl- in Methanol
Sese G, Guardia E, Padro JA
8835 - 8841 Quantum-Statistical Mechanical Simulation of the Ion-Water Cluster I-(H2O)(N) - The Importance of Nuclear Quantum Effects and Anharmonicity
Gai HD, Schenter GK, Dang LX, Garrett BC
8842 - 8848 Dynamics of the Displacement of Co from Cu(111) by H-Atoms Incident from the Gas-Phase
Rettner CT, Auerbach DJ
8849 - 8857 Free-Energy Calculations of Small Molecules in Dense Amorphous Polymers - Effect of the Initial Guess Configuration in Molecular-Dynamics Studies
Vandervegt NF, Briels WJ, Wessling M, Strathmann H
8858 - 8864 Site-Specific Fragmentation in Condensed (Ch3S)(2) by Sulfur K-Edge Photoexcitation
Baba Y, Yoshii K, Sasaki TA
8865 - 8877 Multiconfiguration Time-Dependent Hartree (Mctdh) Study on Rotational and Diffractive Inelastic Molecule-Surface Scattering
Ehara M, Meyer HD, Cederbaum LS
8878 - 8884 Cation Concentration and Local Ligand-Field of Polyether-Salt Complexes
Videira AL, Carlos LD
8885 - 8901 Bulk and Interfacial Thermodynamics of a Symmetrical, Ternary Homopolymer-Copolymer Mixture - A Monte-Carlo Study
Muller M, Schick M
8902 - 8908 Kinetics of Morphological Transition in Polystyrene-Block-Polybutadiene-Block-Polystyrene Triblock Copolymer Melt
Sakurai S, Umeda H, Taie K, Nomura S
8909 - 8913 Dynamics of an Adsorbed Patch and a Model for Spreading of Films of Ultralow Thicknesses
Neogi P
8914 - 8928 Recursive Density-Matrix-Spectral-Moment Algorithm for Molecular Nonlinear Polarizabilities
Tretiak S, Chernyak V, Mukamel S
8929 - 8936 Large-Scale Monte-Carlo Simulations of Center-Adsorbed Star Polymers
Shida K, Ohno K, Kimura M, Kawazoe Y
8937 - 8943 Hydrogen Abstraction from Methane by Li Doped MgO - A Periodic Quantum-Mechanical Study
Orlando R, Cora F, Millini R, Perego G, Dovesi R
8944 - 8950 Coverage, Lateral Order, and Vibrations of Atomic Nitrogen on Ru(0001)
Dietrich H, Jacobi K, Ertl G
8951 - 8957 An Improved Perturbation Approach to the 2D Edwards Polymer - Corrections to Scaling
Shannon SR, Choy TC, Fleming RJ
8958 - 8964 Low-Field Expressions for Reversing-Pulse Electric Birefringence of Ionized Polyions with Permanent, Ionic, and Electronic Dipole-Moments - A Further Extension of the Ion-Fluctuation Theory and the Application to Poly(Alpha,L-Glutamic Acid)
Yamaoka K, Sasai R, Kohno K
8965 - 8968 Experimental-Study of the O-H Ring Vibrations of the Methanol Trimer
Huisken F, Kaloudis M, Koch M, Werhahn O
8969 - 8972 A Linear Scaling Method for Hartree-Fock Exchange Calculations of Large Molecules
Burant JC, Scuseria GE, Frisch MJ
8973 - 8976 Vibrational-Relaxation of a Polyatomic Solute in a Polyatomic Supercritical-Fluid Near the Critical-Point
Urdahl RS, Rector KD, Myers DJ, Davis PH, Fayer MD
8977 - 8978 Characterization of CH Stretches on Diamond C(111) Single-Surfaces and Nanocrystal Surfaces by Infrared-Absorption Spectroscopy
Cheng CL, Lin JC, Chang HC, Wang JK
8979 - 8980 The Effect of Charged Impurities on a Glass-Transition in a Polar Medium - Comment
Miller DP, Depablo JJ, Corti HR
8981 - 8982 The Effect of Charged Impurities on a Glass-Transition in a Polar Medium - Response
Dakhnovskii Y, Lubchenko V