5403 - 5410 |
Ab-Initio Calculations on Ar-No+ - Structure and Vibrational Frequencies Wright TG, Spirko V, Hobza P |
5411 - 5421 |
High-Resolution Zero Kinetic-Energy Photoelectron-Spectra of Para-N-Propylaniline Song XB, Davidson ER, Gwaltney SR, Reilly JP |
5422 - 5431 |
Chain-Length Dependence of Interlayer Interaction in Crystalline N-Alkanes from Raman Longitudinal Acoustic Mode Measurements Snyder RG, Strauss HL, Alamo R, Mandelkern L |
5432 - 5440 |
Improved KrF(B) and KrF(X) State Potentials Lo G, Setser DW |
5441 - 5447 |
Bound-Bound a 2-Sigma+-X 2-Pi Transition of No-Ar Van-der-Waals Complexes Tsuji K, Shibuya K, Obi K |
5448 - 5458 |
2-Photon Wave-Packet Interferometry Engel V, Metiu H |
5459 - 5466 |
Spectra and Relaxation of Hg Atoms and Molecules in Low-Temperature Matrices .1. CH4, CD4, and Mixed CH4/Ar, CD4/Ar Matrices Crepin C, Tramer A |
5467 - 5474 |
Spectra and Relaxation of Hg Atoms and Molecules in Low-Temperature Matrices .2. H2O/Ar and NH3/Ar Matrices Crepin C, Tramer A |
5475 - 5480 |
Spectra and Relaxation of Hg Atoms and Molecules in Low-Temperature Matrices .3. Hgm and Hgmxn (X=h2O and NH3) Systems in Rare-Gas Matrices Crepin C, Tramer A |
5481 - 5490 |
Molecular-Beam Optical Stark Spectroscopy of Cash Scurlock CT, Henderson T, Bosely S, Jung KY, Steimle TC |
5491 - 5500 |
C-60 Vibrates as a Hollow Sphere Ceulemans A, Fowler PW, Vos I |
5501 - 5507 |
Spectral Hole-Burning in Polymorphic Systems - Single-Site Pressure Phenomena and Glassy Behavior Schellenberg P, Friedrich J, Kikas J |
5508 - 5518 |
Overtone and Hot-Band Assignments in the 2(Nu-3, Nu-6) Levels of Chd3 Roche C, Champion JP, Coy SL, Klaassen JJ, Steinfeld JI, Valentin A, Mizugai Y, Johns JW |
5519 - 5532 |
State-to-State Rotational Energy-Transfer Measurements in Methane (Chd3) by Infrared Double-Resonance with a Tunable Diode-Laser Klaassen JJ, Coy SL, Steinfeld JI, Roche C |
5533 - 5545 |
Rotational Resonance with Multiple-Pulse Scaling in Solid-State Nuclear-Magnetic-Resonance Spencer RG, Fishbein KW, Levitt MH, Griffin RG |
5546 - 5549 |
Direct Determination of J Coupling Between 2 Crystallographically Equivalent Spins from 2-Dimensional J-Resolved Nuclear-Magnetic-Resonance Spectra Under Variable-Angle-Spinning Conditions Wu G, Wasylishen RE |
5550 - 5555 |
Photon Fragment-Ion Coincidence Investigation of the Continuous Ultraviolet Emissions Produced by Fast-Ion Impact on CF4 and Chf3 Muller U, Lange M, Haas W, Brenn R |
5556 - 5566 |
Atomic Oxygen in Crystalline Kr and Xe .2. Adiabatic Potential-Energy Surfaces Danilychev AV, Apkarian VA |
5567 - 5579 |
An Improved Quasi-Static Line-Shape Theory - The Effects of Molecular-Motion on the Line Wings Ma Q, Tipping RH |
5580 - 5587 |
Inelastic Electron-Scattering on C-60 Clusters Yabana K, Bertsch GF |
5588 - 5596 |
Experimental-Study of Vibrational-Excitation of Allene by Slow-Electron Impact - Vibronic Coupling in the Short-Lived Negative-Ion States Allan M |
5597 - 5604 |
Decay of Nuclear Magnetization by Bounded Diffusion in a Constant Field Gradient Deswiet TM, Sen PN |
5605 - 5616 |
System-Bath Relaxation Theory Approach to Nonadiabatic Coupling Effects on Condensed-Phase Electronic Absorption-Spectra Evans DG, Coalson RD |
5617 - 5625 |
A Theoretical Description of the B3-Pi-)A3-Sigma+ Transition of No+ Hutter SJ, Hess BA, Marian CM, Samzow R |
5626 - 5630 |
Absolute Cross-Sections for the Electron-Impact Ionization of the NF2 and NF Free-Radicals Tarnovsky V, Levin A, Becker K |
5631 - 5638 |
Quantum Dynamical Studies for Photodissociation of H2O2 at 248 and 266 nm Cai ZT, Zhang DH, Zhang JZ |
5639 - 5645 |
Rotational Temperature-Dependence of the Reactions of N+ and C+ with H2, HD, and D2 Sunderlin LS, Armentrout PB |
5646 - 5655 |
Control of Quantum Dynamics by a Locally Optimized Laser Field - Application to Ring Puckering Isomerization Sugawara M, Fujimura Y |
5656 - 5665 |
Guided-Ion Beam Measurements of N++h2O Charge-Transfer and Chemical-Reaction Channels Dressler RA, Murad E |
5666 - 5683 |
Time-Resolved Double-Resonance Study of J-Changing and K-Changing Rotational Collisional Processes in Ch3Cl Pape TW, Delucia FC, Skatrud DD |
5684 - 5695 |
Properties of Size and Composition Selected Gas-Phase Alkali Fulleride Clusters Weis P, Beck RD, Brauchle G, Kappes MM |
5696 - 5705 |
A Comparison of an Experimental Unimolecular Lifetime Distribution with Rice-Ramsperger-Kassel-Marcus Theory Anicich VG, Sen AD, Mcewan MJ, Smith SC |
5706 - 5714 |
The Formation and Destruction of H3O- Miller TM, Viggiano AA, Miller AE, Morris RA, Henchman M, Paulson JF, Vandoren JM |
5715 - 5725 |
Nickel Group Cluster Anion Reactions with Carbon-Monoxide - Rate Coefficients and Chemisorption Efficiency Hintz PA, Ervin KM |
5726 - 5734 |
Mobilities of He+, Ne+, Ar+, and Kr+ in He Gas at 4.35-K Saito N, Kojima TM, Kobayashi N, Kaneko Y |
5735 - 5750 |
Large Fluctuations and Optimal Paths in Chemical-Kinetics Dykman MI, Mori E, Ross J, Hunt PM |
5751 - 5777 |
Algebraic Variational and Propagation Formalisms for Quantal Dynamics Calculations of Electronic-to-Vibrational, Rotational Energy-Transfer and Application to the Quenching of the 3P State of Sodium by Hydrogen Molecules Tawa GJ, Mielke SL, Truhlar DG, Schwenke DW |
5778 - 5784 |
Combining Doubly-Charged Cations and Anions to Form New Species Gonzales N, Simons J |
5785 - 5791 |
Binding-Energies, Molecular-Structures, and Vibrational Frequencies of Transition-Metal Carbonyls Using Density-Functional Theory with Gradient Corrections Delley B, Wrinn M, Luthi HP |
5792 - 5809 |
State-Selective Multireference Coupled-Cluster Theory Employing the Single-Reference Formalism - Implementation and Application to the H8 Model System Piecuch P, Adamowicz L |
5810 - 5820 |
Theoretical-Studies on Structure, Thermochemistry, Vibrational Spectroscopy, and Other Features of Zrx6(2-) (X=f,Cl,Br,I) - Coulombic Energy in Inorganic and Organic Hexahalogenozirconates Rak J, Gutowski M, Dokurno P, Thanh HV, Blazejowski J |
5821 - 5828 |
Hyperfine Splitting Constants Studied by the Symmetry-Adapted Cluster-Configuration Interaction Method Nakatsuji H, Ehara M, Momose T |
5829 - 5835 |
Fully Optimized Contracted Gaussian-Basis Sets of Triple Zeta Valence Quality for Atoms Li to Kr Schafer A, Huber C, Ahlrichs R |
5836 - 5848 |
Gradient Fields of Potential-Energy Surfaces Ruedenberg K, Sun JQ |
5849 - 5856 |
Hartree-Fock Operators to Improve Virtual Orbitals and Configuration-Interaction Energies Palmieri P, Tarroni R, Rettrup S |
5857 - 5869 |
Solving the Single-Reference Coupled-Cluster Equations Involving Highly Excited Clusters in Quasi-Degenerate Situations Piecuch P, Adamowicz L |
5870 - 5873 |
Quasidiabatic States for Intramolecular Charge-Transfer - Application to the Protonation of NH3 Petsalakis ID, Theodorakopoulos G, Nicolaides CA |
5874 - 5881 |
The Effect of an External Electric-Field on Diffusion-Controlled Bulk Ion Recombination Isoda K, Kouchi N, Hatano Y, Tachiya M |
5882 - 5893 |
Triplet Correlation-Functions for Hard-Spheres - Computer-Simulation Results Bildstein B, Kahl G |
5894 - 5904 |
Numerical-Methods for Locating Stable Periodic-Orbits Embedded in a Largely Chaotic System Marcinek R, Pollak E |
5905 - 5909 |
Inhomogeneities and Relaxation in Supercooled Liquids Mohanty U |
5910 - 5912 |
Reversible 1st-Order Transition Between 2 H2O Amorphs at Similar-to-0.2 GPa and Similar-to-135-K Mishima O |
5913 - 5921 |
Wetting Properties of Simple Binary-Mixtures and Systems with One Self-Associating Component Perez C, Roquero P, Talanquer V |
5922 - 5935 |
Integral-Equation Theory of Polymers - Translational Invariance Approximation and Properties of an Isolated Linear Polymer in Solution Gan HH, Eu BC |
5936 - 5948 |
Effects of Molecular Fluctuations on Chemical Oscillations and Chaos Wu XG, Kapral R |
5949 - 5955 |
Solvent Dynamics Influence on Chemical-Reaction Dynamics Berezhkovskii AM, Dudko SA |
5956 - 5964 |
Dissociative Adsorption of H-2 on Cu(110) - A Mixed Quantum-Classical Study Kumar S, Jackson B |
5965 - 5976 |
Grand-Canonical Monte-Carlo Simulations of the Distribution and Chemical-Shifts of Xenon in the Cages of Zeolite NAA .1. Distribution and Xe-129 Chemical-Shifts Jameson CJ, Jameson AK, Baello BI, Lim HM |
5977 - 5987 |
Grand-Canonical Monte-Carlo Simulations of the Distribution and Chemical-Shifts of Xenon in the Cages of Zeolite NAA .2. Structure of the Adsorbed Fluid Jameson CJ, Jameson AK, Lim HM, Baello BI |
5988 - 5995 |
Inner-Shell Excitation and Site-Specific Fragmentation of Poly(Methylmethacrylate) Thin-Film Tinone MC, Tanaka K, Maruyama J, Ueno N, Imamura M, Matsubayashi N |
5996 - 6010 |
Modeling of Complex Biological-Systems .1. Molecular-Dynamics Studies of Diglyceride Monolayers Peters GH, Toxvaerd S, Svendsen A, Olsen OH |
6011 - 6018 |
The Preparation of Polymer Melt Samples for Computer-Simulation Studies Brown D, Clarke JH, Okuda M, Yamazaki T |
6019 - 6027 |
Self-Quenching of Nitrobenzoxadiazole Labeled Phospholipids in Lipid-Membranes Brown RS, Brennan JD, Krull UJ |
6028 - 6037 |
Critical-Dynamics and Diffusion Behavior of Polymer Blend Solutions of Polystyrene Poly(Methylmethacrylate)/D6-Benzene Miyashita N, Nose T |
6038 - 6045 |
When Is a Potential Accurate Enough for Structure Prediction - Theory and Application to a Random Heteropolymer Model of Protein-Folding Bryngelson JD |
6046 - 6054 |
Rotational Reorientation Dynamics of Disperse Red-1 in Polystyrene - Alpha-Relaxation Dynamics Probed by 2nd-Harmonic Generation and Dielectric-Relaxation Dhinojwala A, Wong GK, Torkelson JM |
6055 - 6061 |
Hydrodynamic Shielding Induced Stability of Zipping Macromolecules in Elongational Flows Agarwal US, Mashelkar RA |
6062 - 6072 |
Measurement of the Molecular Content of Binary Nuclei .2. Use of the Nucleation Rate Surface for Water-Ethanol Viisanen Y, Strey R, Laaksonen A, Kulmala M |
6073 - 6081 |
Stochastic-Model for the A+b2 Surface-Reaction - Island Formation and Complete Segregation Mai J, Kuzovkov VN, Vonniessen W |
6082 - 6087 |
Lattice Model for Polymer Propagation in Confined Media Tribet C, Provata A, Nicolis G |
6088 - 6091 |
Numerical Test of the Generalized Flory and Generalized Flory Dimer Theories Mooij GC, Frenkel D |
6092 - 6097 |
Coadsorbate Induced Compression of Sulfur Overlayers on Re(0001) and Pt(111) by Co Dunphy JC, Mcintyre BJ, Gomez J, Ogletree DF, Somorjai GA, Salmeron MB |
6098 - 6100 |
New Measurement Method of the Autocorrelation Function in the Quasi-Elastic Light-Scattering with the Sinusoidal Electric-Field Ito K, Ooi S, Nishi N, Kimura Y, Hayakawa R |
6101 - 6101 |
Quadratic Steepest Descent on Potential-Energy Surfaces .4. Adaptation to Singular Hessians Ruedenberg K, Sun JQ |
6102 - 6103 |
A Note on the Temperature-Dependence of Dielectric Strength in Supercooled Liquids Murthy SS |
6104 - 6104 |
Pair Interaction Energy Between Deformable Drops and Bubbles, (Vol 99, Pg 7179, 1993) Danov KD, Petsev DN, Denkov ND, Borwankar R |