| 1 - 5 |
Photoionization Spectroscopy of Yttrium Clusters - Ionization-Potentials for Y-N and Yno (N=2-31)
Knickelbein M |
| 6 - 12 |
Matrix-Isolation Study of the Interaction of Excited Neon Atoms with NF3 - Infrared-Spectra of Nf3+, Nf2+, and NF2-
Jacox ME, Thompson WE |
| 13 - 19 |
Infrared-Spectra of CF4 Adsorbed on Ice - Probing Adsorbate Dilution and Phase-Separation with the Nu(3) Transverse-Longitudinal Splitting
Rowland B, Kadagathur NS, Devlin JP |
| 20 - 33 |
The Dynamics of One-Dimensional Excitons in Liquids
Vanburgel M, Wiersma DA, Duppen K |
| 34 - 38 |
On the Jahn-Teller Effect on Mn2+ in Zincblende ZnS Crystal
Stavrev KK, Zerner MC |
| 39 - 47 |
Photoelectron-Spectroscopy of the Solvated Anion Clusters O-(Ar)(N=1-26,34) - Energetics and Structure
Arnold ST, Hendricks JH, Bowen KH |
| 48 - 56 |
Rydberg and Charge-Transfer Slates of F-Atoms in Neon Matrices
Bressler C, Lawrence WG, Schwentner N |
| 57 - 66 |
Photoelectron-Spectroscopy of Color-Centers in Negatively Charged Cesium Iodide Nanocrystals
Sarkas HW, Kidder LH, Bowen KH |
| 67 - 74 |
Dipole Mechanism of Line Broadening in Amorphous Solids
Ovchinnikov MA, Wight CA |
| 75 - 89 |
Linking Structure and Vibrational-Mode Coupling Using High-Resolution Infrared-Spectroscopy - A Comparison of Gauche and Trans 1-Chloro-2-Fluoroethane
Miller CC, Stone SC, Philips LA |
| 90 - 103 |
Momentum-Space Ionization Spectroscopy of iso-Dichloroethylene - A Comparative (E,2E) Study of Electron Momentum Distributions of the Frontier-Orbital and Innervalence Many-Body States in iso-Dichloroethylene and Its Cis and Trans Isomers
Chuaqui MH, Mei L, Mathers CP, Allison ML, Ying JF, Leung KT |
| 104 - 118 |
The Reactive Flux Method in the Energy Diffusion Regime .2. Importance of the Solvents Spectral Profile
Reese SK, Tucker SC, Schenter GK |
| 119 - 123 |
Dissociative Electron-Attachment Cross-Sections for Halofluoromethanes
Underwoodlemons T, Gergel TJ, Moore JH |
| 124 - 132 |
A Time-Dependent Approach to Flux Calculation in Molecular Photofragmentation - Vibrational Predissociation of HF-DF
Zhang DH, Wu Q, Zhang JZ |
| 133 - 144 |
Nascent Vibrational Populations in He-Asterisk(2 S-1,S-3)+h-2, HD, D-2 Penning Ionization from Electron-Spectroscopy in Crossed Supersonic Molecular-Beams
Bevsek HM, Dunlavy DC, Siska PE |
| 145 - 154 |
Optothermal Detection of Nonradiative Relaxation Channels in Electronically Excited Molecules
Miller CC, Hewett KB, Shen MH, Philips LA |
| 155 - 160 |
Activation Barriers for Series of Exothermic Homologous Reactions .4. Comparison of Measurements to Theory for Reactions of S(2)P(1) Atoms with N2O
Belyung DP, Futerko PM, Fontijn A |
| 161 - 169 |
Computational Studies of the Potential-Energy Surface for O(P-3)+h2S - Characterization of Transition-States and the Enthalpy of Formation of Hso and Hos
Goumri A, Laakso D, Rocha JD, Smith CE, Marshall P |
| 170 - 179 |
Dissociation Dynamics of a Field-Evaporated Diatomic Ion - Rovibrational Coupling, Isotope Effects, and Fractal Field Thresholds
Yuan JM, Wei CM, Tsong TT |
| 180 - 188 |
Investigation of the Arn2+ Ion by Dissociative Ionization of Argon Nitrogen Clusters
Mahnert J, Baumgartel H, Weitzel KM |
| 189 - 192 |
Studies of C-60 Metal Reactions in the Laser-Ablation Plasma of C-60/M(2)O(3) (M=la, Y, Eu, Gd)
Huang RB, Lu WY, Yang SH |
| 193 - 213 |
Barriers, Thresholds, and Resonances - Spectral Quantization of the Transition-State for the Collinear D+h-2 Reaction
Sadeghi R, Skodje RT |
| 214 - 225 |
A Guided-Ion Beam Study of the Hydrogen-Atom Transfer-Reaction of State-Selected N-2(+) with H-2 at Collision Energies Ranging from Subthermal to 2-eV (cm)
Knott WJ, Proch D, Kompa KL, Rosepetruck C |
| 226 - 236 |
A New Approach to Molecular Classical Optimal-Control - Application to the Reaction HCN-)Hc+n
Botina J, Rabitz H, Rahman N |
| 237 - 250 |
A Pi-Cl Approach to the Study of Correlation-Effects on the Nonlinear-Optical Properties in Organic Pi-Conjugated Systems
Albert ID, Morley JO, Pugh D |
| 251 - 253 |
Gauge-Invariant Calculation of Nuclear Magnetic Shielding Constants at the Coupled-Cluster Singles and Doubles Level
Gauss J, Stanton JF |
| 254 - 261 |
An Accurate Ab-Initio Quartic Force-Field and Vibrational Frequencies for CH4 and Isotopomers
Lee TJ, Martin JM, Taylor PR |
| 262 - 277 |
Accurate Multireference Configuration-Interaction Calculations on the Lowest (1)Sigma(+) and 3-Pi Electronic States of Ca-2, Cn+, Bo+n, and Bo+
Peterson KA |
| 278 - 284 |
How Can (Semi)Local Density-Functional Theory Account for the Ground-State Total-Energy of Highly Ionized Atoms of the First 3 Periods in the Periodic-Table
Kristyan S |
| 285 - 293 |
Gauge-Invariant Basis-Sets for Magnetic Property Calculations
Sugimoto M, Nakatsuji H |
| 294 - 300 |
Electron Propagator Calculations on Linear and Branched Carbon Cluster Dianions
Zakrzewski VG, Ortiz JV |
| 301 - 309 |
Lambda-Doublet and Spin-Doublet Population-Distributions in the Products of Photofragmentation via Coupled Electronic Channels - H2O((B)over-Tilde(1)A(1))-)H+oh(X(2)Pi)
Dixon RN |
| 310 - 317 |
Harmonic Vibrational Frequencies of the Water Monomer and Dimer - Comparison of Various Levels of Ab-Initio Theory
Kim JS, Lee JY, Lee S, Mhin BJ, Kim KS |
| 318 - 326 |
Local-Scaling Transformations and the Direct Determination of Kohn-SHAM Orbitals and Potentials for Beryllium
Ludena EV, Maldonado J, Lopezboada R, Koga T, Kryachko ES |
| 327 - 336 |
Compact Model Potentials for Ab-Initio Embedded-Cluster Calculations .1. Basic Formulation
Mejias JA, Sanz JF |
| 337 - 345 |
How Robust Are Molecular-Properties - A Stability-Criterion for Eigenstates
Schmid GM, Coy SL, Field RW, Silbey RJ |
| 346 - 354 |
Efficient Molecular Numerical-Integration Schemes
Treutler O, Ahlrichs R |
| 355 - 363 |
Ab-Initio Study of the Acetylene and Vinylidene Dications Fragmentation
Duflot D, Robbe JM, Flament JP |
| 364 - 370 |
Conformational Behavior of Gaseous Glycine by a Density-Functional Approach
Barone V, Adamo C, Lelj F |
| 371 - 383 |
Rules for Developing Basis-Sets for the Accurate Computation of Hyperpolarizabilities - Applications to He, H-2, Be, Ne, F-, and HF
Papadopoulos MG, Waite J, Buckingham AD |
| 384 - 393 |
Validation of Self-Consistent Hybrid Density Functionals for the Study of Structural and Electronic Characteristics of Organic Pi-Radicals
Adamo C, Barone V, Fortunelli A |
| 394 - 399 |
Ab-Initio Characterization of Electronically Excited-States in Highly Unsaturated-Hydrocarbons
Sobolewski AL, Adamowicz L |
| 400 - 413 |
Line and Boundary Tensions at the Wetting Transition - 2 Fluid Phases on a Substrate
Perkovic S, Blokhuis EM, Han G |
| 414 - 418 |
Diffusivity in a Nonionic Surfactant Water Mixture of Critical Composition
Lesemann M, Zielesny A, Belkoura L, Woermann D |
| 419 - 426 |
The Potentials of Mean Force of Sodium-Chloride and Sodium Dimethylphosphate in Water - An Application of Adaptive Umbrella Sampling
Friedman RA, Mezei M |
| 427 - 431 |
Molecular-Dynamics Simulation of Iron(III) and Its Hydrolysis Products in Aqueous-Solution
Rustad JR, Hay BP, Halley JW |
| 432 - 436 |
A Scaling and Mapping-Theory for Excess Electrons in Simple Fluids
Cao JS, Berne BJ |
| 437 - 449 |
The Correlation-Functions of Hard-Sphere Chain Fluids - Comparison of the Wertheim Integral-Equation Theory with the Monte-Carlo Simulation
Chang JE, Sandler SI |
| 450 - 456 |
Effect of the Treatment of Long-Range Forces on the Dynamics of Ions in Aqueous-Solutions
Perera L, Essmann U, Berkowitz ML |
| 457 - 464 |
Inherent Structures in the Potential-Energy Landscape of Solid He-4
Hodgdon JA, Stillinger FH |
| 465 - 470 |
Nonlinear Relaxation and Solvation Dynamics in a Coulomb Lattice-Gas
Knodler D, Dieterich W, Lonsky C, Nitzan A |
| 471 - 479 |
How Do Molecules Move Near T-G - Molecular Rotation of 6 Probes in O-Terphenyl Across 14 Decades in Time
Cicerone MT, Blackburn FR, Ediger MD |
| 480 - 495 |
Volume Fraction Dependence and Reorganization in Cluster-Cluster Aggregation Processes
Vangarderen HF, Dokter WH, Beelen TP, Vansanten RA, Pantos E, Michels MA, Hilbers PA |
| 496 - 510 |
Methods for Molecular-Dynamics with Nonadiabatic Transitions
Coker DF, Xiao L |
| 511 - 524 |
Influence of Surface-Topology and Electrostatic Potential on Water Electrode Systems
Siepmann JI, Sprik M |
| 525 - 528 |
On O- Emission from Cesium-Coated Surfaces
Wang YC |
| 529 - 539 |
Calculation of Solvent-Free Energies for Heterogeneous Electron-Transfer at the Water-Metal Interface - Classical Versus Quantum Behavior
Straus JB, Calhoun A, Voth GA |
| 540 - 543 |
Formation of C-119 by Thermal-Decomposition of C60O
Beck RD, Brauchle G, Stoermer C, Kappes MM |
| 544 - 550 |
Desorption-Kinetics of Copper Fluorides in the Reaction of Fluorine with Copper Surfaces
Sugawara K, Wach T, Wanner J, Jakob P |
| 551 - 555 |
Bending of N-Isopropylacrylamide Gel Under the Influence of Infrared Light
Zhang XM, Li Y, Hu ZB, Littler CL |
| 556 - 562 |
Spinodals in a Polymer-Dispersed Liquid-Crystal
Shen CS, Kyu T |
| 563 - 572 |
Isotope Effect in Electron-Stimulated Desorption - The Role of Internal Degrees of Freedom in Co Desorption from Pt(111)
Szabo A, Yates JT |
| 573 - 577 |
Kinetics of Homopolymer Collapse
Byrne A, Kiernan P, Green D, Dawson KA |
| 578 - 584 |
Molecular-Dynamics Simulation of the Photodissociation of Adsorbed HCl on a MgO(001) Surface
Hintenender M, Rebentrost F, Gerber RB, Kosloff R |
| 585 - 604 |
Theory of Nonequilibrium Effects on the Conformation of Polymers
Eu BC, Gan HH |
| 605 - 610 |
Cluster Adsorption on Metallic Surfaces - Structure and Diffusion in the Cu/Pd(110) and Pd/Pd(110) Systems
Massobrio C, Fernandez P |
| 611 - 614 |
The First Vibronically Resolved Measurement of Correlated-Product-State Distributions in Ultraviolet Photodissociation - Ketene at 308-nm
Drabbels M, Morgan CG, Mcguire DS, Wodtke AM |
| 615 - 617 |
On the Use of Liquid-Helium Cluster Beams for the Preparation and Spectroscopy of the Triplet-States of Alkali Dimers and Other Weakly-Bound Complexes
Stienkemeier F, Ernst WE, Higgins J, Scoles G |
| 618 - 619 |
On the Selective Lambda-Doublet Relaxation in CH(X (2)Pi, Nu=0,N)
Heinrich P, Stuhl F |
