Journal of Physical Chemistry B

Journal of Physical Chemistry B, Vol.113, No.13 Entire volume, number list

ISSN: 1520-6106 (Print)

In this Issue (61 articles)

3997 - 3999	Aqueous Solutions and Their Interfaces Xantheas SS, Voth GA
4000 - 4007	The Effect of the Incident Collision Energy on the Porosity of Vapor-Deposited Amorphous Solid Water Films Smith RS, Zubkov T, Dohnalek Z, Kay BD
4008 - 4016	Water Modeled As an Intermediate Element between Carbon and Silicon Molinero V, Moore EB
4017 - 4030	Hydrated Excess Proton at Water-Hydrophobic Interfaces Iuchi S, Chen HN, Paesani F, Voth GA
4031 - 4037	Photoinduced Electron Transfer and Solvation in Iodide-doped Acetonitrile Clusters Ehrler OT, Griffin GB, Young RM, Neumark DM
4038 - 4044	Destabilization of the Hydrogen-Bond Structure of Water by the Osmolyte Trimethylamine N-Oxide Rezus YLA, Bakker HJ
4045 - 4053	Hydrogen Bond Dynamics at the Water/Hydrocarbon Interface Chowdhary J, Ladanyi BM
4054 - 4064	Solution Structure of NaNO3 in Water: Diffraction and Molecular Dynamics Simulation Study Megyes T, Balint S, Peter E, Grosz T, Bako I, Krienke H, Bellissent-Funel MC
4065 - 4074	Toward a Simple Molecular Understanding of Sum Frequency Generation at Air-Water Interfaces Noah-Vanhoucke J, Smith JD, Geissler PL
4075 - 4081	Influence of Concentration and Anion Size on Hydration of H+ Ions and Water Structure Mancinelli R, Sodo A, Bruni F, Ricci MA, Soper AK
4082 - 4092	Hydration Water Dynamics Near Biological Interfaces Johnson ME, Malardier-Jugroot C, Murarka RK, Head-Gordon T
4093 - 4101	How Interfaces Affect Hydrophobically Driven Polymer Folding Jamadagni SN, Godawat R, Dordick JS, Garde S
4102 - 4110	Water Structure at the Air-Aqueous Interface of Divalent Cation and Nitrate Solutions Xu M, Spinney R, Allen HC
4111 - 4118	A Modified MSEVB Force Field for Protonated Water Clusters Kumar R, Christie RA, Jordan KD
4119 - 4124	What are the Sites Water Occupies at the Interface of a Phospholipid Membrane? Volkov VV, Takaoka Y, Righini R
4125 - 4130	Vibrational Sum-Frequency Spectroscopy of the Water Liquid/Vapor Interface Auer BM, Skinner JL
4131 - 4140	Infrared Spectroscopy and Optical Constants of Porous Amorphous Solid Water Cholette F, Zubkov T, Smith RS, Dohnalek Z, Kay BD, Ayotte P
4141 - 4146	Computational Investigation of the First Solvation Shell Structure of Interfacial and Bulk Aqueous Chloride and Iodide Ions Wick CA, Xantheas SS
4147 - 4151	Distribution of Binding Energies of a Water Molecule in the Water Liquid-Vapor Interface Chempath S, Pratt LR
4152 - 4160	Toward Understanding the Dissociation of Weak Acids in Water: 1. Using IR Spectroscopy to Identify Proton-Shared Hydrogen-Bonded Ion-Pair Intermediates Thomas V, Iftimie R
4161 - 4169	Microscopic Wetting of Mixed Self-assembled Monolayers: A Molecular Dynamics Study Szori M, Tobias DJ, Roeselova M
4170 - 4175	Electronic Effects in the IR Spectrum of Water under Confinement Donadio D, Cicero G, Schwegler E, Sharma M, Galli GL
4176 - 4180	Molecular Orientation and Field-effect Transistors of a Rigid Rod Conjugated Polymer Thin Films Dong HL, Li HX, Wang E, Yan S, Zhang JM, Yang CM, Takahashi I, Nakashima H, Torimitsu K, Hu WP
4181 - 4183	Ultrastable Superbase-Derived Protic Ionic Liquids Luo HM, Baker GA, Lee JS, Pagni RM, Dai S
4184 - 4186	Rapid Thermal Tuning of Chromophore Structure in Membrane Protein Wang JP, El-Sayed MA
4187 - 4196	Thermally Induced Polymeric Assemblies from the PAAc-Based Copolymer Containing Both PNIPAAm and mPEG Grafts in Water Chiang WH, Hsu YH, Chern CS, Chiu HC
4197 - 4202	Lattice Dynamics of Oligo(phenylenethienylene)s: A Far-infrared and Inelastic Neutron Scattering Study Hermet P, Lois-Sierra S, Bantignies JL, Rols S, Sauvajol JL, Serein-Spirau F, Lere-Porte JP, Moreau JJE
4203 - 4208	Synergetic Effect of Efficient Energy Transfer and 3D pi-pi Stack for White Emission Based on the Block Copolymers Containing Nonconjugated Spacer Lu JJ, Li H, Yao B, Zhao B, Weng C, Lei GT, Shen P, Xie ZY, Tan ST
4209 - 4217	Designing Amphotropic Smectic Liquid Crystals Based on Phosphonium Salts for Partial Ordering of Solutes as Monitored by NMR Spectroscopy Shahkhatuni AA, Ma KF, Weiss RG
4218 - 4225	Self-Assembly of Asymmetric Poly(ethylene oxide)-block-Poly (n-butyl acrylate) Diblock Copolymers in Aqueous Media to Unexpected Morphologies Petrov PD, Drechsler M, Muller AHE
4226 - 4231	Poly(N-vinylimidazole) Gels as Insoluble Buffers that Neutralize Acid Solutions without Dissolving Horta A, Pierola IF
4232 - 4241	Modeling the Buildup of Exponentially Growing Polyelectrolyte Multilayer Films Hoda N, Larson RG
4242 - 4247	Positively Charged Residues in DNA-Binding Domains of Structural Proteins Follow Sequence-specific Positions of DNA Phosphate Groups Cherstvy AG
4248 - 4256	UV Resonance Raman Determination of Molecular Mechanism of Poly(N-isopropylacrylamide) Volume Phase Transition Ahmed Z, Gooding EA, Pimenov KV, Wang LL, Asher SA
4257 - 4266	Diffusion of Water in Nafion Using Time-Resolved Fourier Transform Infrared-Attenuated Total Reflectance Spectroscopy Hallinan DT, Elabd YA
4267 - 4274	Molecular Simulation of Water/Alcohol Mixtures' Adsorption and Diffusion in Zeolite 4A Membranes Wu JY, Liu QL, Xiong Y, Zhu AM, Chen Y
4275 - 4283	Search for the Molecular Mechanism of Mercury Toxicity. Study of the Mercury(II)-Surfactant Complex Formation in Langmuir Monolayers Broniatowski M, Dynarowicz-Latka P
4284 - 4292	Characterization of Multifunctional Reverse Micelles' Interfaces Using Hemicyanines as Molecular Probes. I. Effect of the Hemicyanines' Structure Moyano F, Quintana SS, Falcone RD, Silber JJ, Correa NM
4293 - 4302	Temperature and Pressure Dependence of the Diffusion Coefficients and NMR Relaxation Times of Mixtures of Alkanes Freed DE
4303 - 4313	Hyperquenched Glassy Water and Hyperquenched Glassy Ethanol Probed by Single Molecule Spectroscopy Reinot T, Dang NC, Jankowiak R
4314 - 4322	Solvent Effects on Global Reactivity Properties for Neutral and Charged Systems Using the Sequential Monte Carlo Quantum Mechanics Model Jaramillo P, Perez P, Fuentealba P, Canuto S, Coutinho K
4323 - 4332	Activity Coefficients at Infinite Dilution of Organic Solutes in the Ionic Liquid 1-Ethyl-3-methyl-imidazolium Nitrate Sobota M, Dohnal V, Vrbka P
4333 - 4337	Raman Characterization of a New Te-Rich Binary Compound: CdTe2 Rousset J, Rzepka E, Lincot D
4338 - 4346	Raman Spectroscopic Study, DFT Calculations and MD Simulations on the Conformational Isomerism of N-Alkyl-N-methylpyrrolidinium Bis-(trifluoromethanesulfonyl) Amide Ionic Liquids Umebayashi Y, Mitsugi T, Fujii K, Seki S, Chiba K, Yamamoto H, Lopes JNC, Padua AAH, Takeuchi M, Kanzaki R, Ishiguro S
4347 - 4359	Thermodynamics of the Clusterization Process of Cis Isomers of Unsaturated Fatty Acids at the Air/Water Interface Vysotsky YB, Belyaeva EA, Fainerman VB, Vollhardt D, Aksenenko EV, Miller R
4360 - 4371	Modeling Tetraalkylammonium Halide Salts in Water: How Hydrophobic and Electrostatic Interactions Shape the Thermodynamic Properties Krienke H, Vlachy V, Ahn-Ercan G, Bako I
4372 - 4378	The Hydration Structure of Sn(II): An ab initio Quantum Mechanical Charge Field Molecular Dynamics Study Lim LHV, Hofer TS, Pribil AB, Rode BM
4379 - 4383	Mutarotation in D-Fructose Melt Monitored by Dielectric Spectroscopy Wlodarczyk P, Kaminski K, Paluch M, Ziolo J
4384 - 4393	Heterogeneity and Relaxation Dynamics of the Photoexcited Retinal Schiff Base Cation in Solution Zgrablic G, Haacke S, Chergui M
4394 - 4399	Dynamical Transition of Water in the Grooves of DNA Duplex at Low Temperature Biswal D, Jana B, Pal S, Bagchi B
4400 - 4406	Positioning of Micelle-Bound Peptides by Paramagnetic Relaxation Enhancements Zangger K, Respondek M, Goebl C, Hohlweg W, Rasmussen K, Grampp G, Madl T
4407 - 4412	Hetero-Ring-Expansion Design for Adenine-Based DNA Motifs: Evidence from DFT Calculations and Molecular Dynamics Simulations Han L, Li HF, Cukier RI, Bu YX
4413 - 4424	Hybrid Coarse-Graining Approach for Lipid Bilayers at Large Length and Time Scales Ayton GS, Voth GA
4425 - 4434	Solvent Reorganization Energies in A-DNA, B-DNA, and Rhodamine 6G-DNA Complexes from Molecular Dynamics Simulations with a Polarizable Force Field Vladimirov E, Ivanova A, Rosch N
4435 - 4442	Bulky Side Chains and Non-native Salt Bridges Slow down the Folding of a Cross-Linked Helical Peptide: A Combined Molecular Dynamics and Time-Resolved Infrared Spectroscopy Study Paoli B, Seeber M, Backus EHG, Ihalainen JA, Hamm P, Caflisch A
4443 - 4455	Solvent-Free Lipid Bilayer Model Using Multiscale Coarse-Graining Izvekov S, Voth GA
4456 - 4465	V-51 NMR Chemical Shifts Calculated from QM/MM Models of Peroxo Forms of Vanadium Haloperoxidases Geethalakshmi KR, Waller MP, Thiel W, Buhl M
4466 - 4474	Fluorescence Lifetimes of Tyrosine Residues in Cytochrome c'' as Local Probes to Study Protein Unfolding Noronha M, Santos R, Paci E, Santos H, Macanita AL
4475 - 4481	Orientation and Dynamics of a Novel Fluorescent Cholesterol Analogue in Membranes of Varying Phase Shrivastava S, Haldar S, Gimpl G, Chattopadhyay A
4482 - 4491	Efficient Approach to Determine the pK(a) of the Proton Release Complex in the Photocycle of Retinal Proteins Wu J, Ma DW, Wang YZ, Ming M, Balashov SP, Ding JD
4492 - 4499	Low-Frequency Heme, Iron-Ligand, and Ligand Modes of Imidazole and Imidazolate Complexes of Iron Protoporphyrin and Microperoxidase in Aqueous Solution. An Analysis by Far-Infrared Difference Spectroscopy Marboutin L, Desbois A, Berthomieu C