| 1091 - 1097 |
A Tribute to Friedman,Harold,L
Rossky PJ, Steele WA |
| 1098 - 1103 |
Structures and Energies of SiO2 Clusters
Harkless JA, Stillinger DK, Stillinger FH |
| 1104 - 1110 |
Orbital Analysis of Metal-to-Ligand Charge-Transfer and Oxidation in (NH3)(5)Rul(2+) Complexes - Effective T(2G) Orbital Ordering and the Role of Ligand-Pi and Ligand-Pi-Asterisk Orbitals
Shin YG, Brunschwig BS, Creutz C, Newton MD, Sutin N |
| 1111 - 1117 |
Solvent Effect on Acidity - A Hybrid Approach Based on the RISM and the Hartree-Fock Equations
Kawata M, Tenno S, Kato S, Hirata F |
| 1118 - 1128 |
Curve Crossing Formulation for Proton-Transfer Reactions in Solution
Borgis D, Hynes JT |
| 1129 - 1136 |
Instantons and the Fluctuating Path Description of Reactions in Complex Environments
Wang J, Wolynes P |
| 1137 - 1143 |
Properties of Quantum Transition-State Theory and Its Corrections
Hansen NF, Andersen HC |
| 1144 - 1152 |
Crystalline and Amorphous Phases in the Ternary-System Water-Sucrose-Sodium Chloride
Shalaev EY, Franks F, Echlin P |
| 1153 - 1158 |
Free-Energy Calculations by Expanded Ensemble Method for Lattice and Continuous Polymers
Vorontsovvelyaminov PN, Broukhno AV, Kuznetsova TV, Lyubartsev AP |
| 1159 - 1163 |
Activity Measurements in Nickel-Platinum Alloys
Lantelme F, Salmi A |
| 1164 - 1173 |
A Numerical Study of Polyampholyte Configuration
Bratko D, Chakraborty AK |
| 1174 - 1180 |
Structure and Exciton Dynamics in J-Aggregates Studied by Polarization-Dependent Near-Field Scanning Optical Microscopy
Higgins DA, Reid PJ, Barbara PF |
| 1181 - 1188 |
Probe Ion Diffusivity Measurements in Salt-in-Polymer Electrolytes - Stokes Radii and the Transport Number Problem
Mclin MG, Angell CA |
| 1189 - 1196 |
Adsorption of Water on Activated Carbons - A Molecular Simulation Study
Muller EA, Rull LF, Vega LF, Gubbins KE |
| 1197 - 1205 |
Solution of the Ornstein-Zernike Equation for Spheres with Octupolar Surface-Adhesion - Toward a Simple-Model of Water
Blum L, Vericat F |
| 1206 - 1215 |
Free-Energy of Ionic Hydration
Hummer G, Pratt LR, Garcia AE |
| 1216 - 1219 |
Quaternary Liquid-Mixtures Separating into 4 Liquid-Phases
Firman P, Kahlweit M |
| 1220 - 1226 |
Binary Mixing Approximations and Relations Between Specific Conductance, Molar Conductance, Equivalent Conductance, and Ionar Conductance for Mixtures
Miller DG |
| 1227 - 1237 |
Quadrupole Polarization in Simulations of Ionic Systems - Application to AgCl
Wilson M, Madden PA, Costacabral BJ |
| 1238 - 1245 |
Solvation Dynamics in Slow, Viscous-Liquids - Application to Amides
Biswas R, Bagchi B |
| 1246 - 1255 |
Brownian Dynamics Derivation of the Association Formulation for the Conductance Equations
Justice JC |
| 1256 - 1265 |
A Parameter as an Indicator for Water-Water Association in Solutions of Strong Electrolytes
Muller KJ, Hertz HG |
| 1266 - 1282 |
Short-Time Dynamics of Solvation - Relationship Between Polar and Nonpolar Solvation
Ladanyi BM, Stratt RM |
| 1283 - 1287 |
Effects of Electronegative Substituents of Anions on Ion-Pair Formation .1. Temperature-Dependence of the Conductivity of Lithium Fluoroacetate and Alkali-Metal Acetate Solutions in Dimethyl-Sulfoxide
Barthel J, Gores HJ, Kraml L |
| 1288 - 1294 |
Modeling the Heat-Capacities of Aqueous 1-1 Electrolyte-Solutions with Pitzer Equations
Criss CM, Millero FJ |
| 1295 - 1302 |
Electronic and Solvent Relaxation Dynamics of a Photoexcited Aqueous Halide
Sheu WS, Rossky PJ |
| 1303 - 1308 |
Effect of Xenon upon the Dynamical Anomalies of Supercooled Water - A Test of Scaling-Law Behavior
Weingartner H, Haselmeier R, Holz M |
| 1309 - 1316 |
Microstructure of Ambient and Supercritical Water - Direct Comparison Between Simulation and Neutron-Scattering Experiments
Chialvo AA, Cummings PT |
| 1317 - 1322 |
Aqueous-Solutions and Neutron-Scattering
Neilson GW, Enderby JE |
| 1323 - 1329 |
Dependence of Hydration Free-Energy on Solute Size
Perkyns J, Pettitt BM |
| 1330 - 1335 |
Correlations and Thermodynamic Coefficients in Dilute Asymmetric Electrolyte-Solutions
Knackstedt MA, Ninham BW |
| 1336 - 1339 |
Systematic Study of the Spectroscopic Properties of Isotopically Substituted Water by MD Simulations
Lu TH, Toth G, Heinzinger K |
| 1340 - 1344 |
Electrolytic Conductivities and Mixing Coefficients of the Aqueous HCl-H2SO4 System
Wu YC, Sorensen J |
| 1345 - 1349 |
Dynamics of Hydrophobic Hydration of Benzene
Nakahara M, Wakai C, Yoshimoto Y, Matubayasi N |
| 1350 - 1356 |
Thermally-Induced Structural-Changes in F-(H2O)(11) and Cl-(H2O)(11) Clusters - Molecular-Dynamics Computer-Simulations
Sremaniak LS, Perera L, Berkowitz ML |
| 1357 - 1367 |
Orientation of Water-Molecules Around Small Polar and Nonpolar Groups in Solution - A Neutron-Diffraction and Computer-Simulation Study
Soper AK, Luzar A |
| 1368 - 1380 |
Wave Vector-Dependent Dielectric-Relaxation of Methanol-Water Mixtures
Ladanyi BM, Skaf MS |
| 1381 - 1391 |
Raman OD-Stretching Overtone Spectra from Liquid D2O Between 22 and 152-Degrees-C
Walrafen GE, Yang WH, Chu YC, Hokmabadi MS |
| 1392 - 1405 |
Molecular-Dynamics Simulation Study of Polarizable Solute Solvation in Water .1. Equilibrium Solvent Structure and Solute Rotational-Dynamics
Bursulaya BD, Zichi DA, Kim HJ |
| 1406 - 1410 |
Use of Experimental Diffusion-Coefficients to Probe Solute-Solute and Solute-Solvent Interactions in Electrolyte-Solutions
Price WE, Mills R, Woolf LA |
| 1411 - 1414 |
Frequency-Dependent and Wave-Vector-Dependent Susceptibility of Water
Trokhymchuk A, Holovko M |
| 1415 - 1419 |
Phase-Separation of Ionic Fluids - An Extended Ebeling-Grigo Approach
Yeh SG, Zhou YQ, Stell G |
| 1420 - 1425 |
Molecular-Dynamics Simulation of Ion Mobility .2. Alkali-Metal and Halide-Ions Using the SPC/E Model for Water at 25-Degrees-C
Lee SH, Rasaiah JC |
| 1426 - 1433 |
Use of the Grand-Canonical Ensemble in Potential of Mean Force Calculations
Resat H, Mezei M, Mccammon JA |
