Measurement of photolysis branching ratios of 2-bromopropane at 234 and 267Â nm Fulltext Access 5 Pages 2005
Particular interaction between efavirenz and the HIV-1 reverse transcriptase binding site as explained by the ONIOM2 method Fulltext Access 5 Pages 2005
Aggregation and interactions of C60 and C70 fullerenes in neat N-methylpyrrolidinone and in N-methylpyrrolidinone/toluene mixtures Fulltext Access 5 Pages 2005
Monte-Carlo simulations of photoinduced fluorescence enhancement in semiconductor quantum dot arrays Fulltext Access 5 Pages 2005
Molecular dynamics in smectic A and chiral smectic C phases by deuteron spin relaxation study Fulltext Access 5 Pages 2005
Comparative calculations for the A-frame molecules [S(MPH3)2] (MÂ =Â Cu, Ag, Au) at levels up to CCSD(T) Fulltext Access 5 Pages 2005
Role of surface geometry and electronic structure in STM images of O/Ru(0Â 0Â 0Â 1) Fulltext Access 5 Pages 2005
A theoretical study of the structural and electronic properties of CdSe/CdS and CdS/CdSe core/shell nanoparticles Fulltext Access 5 Pages 2005
Density-functional calculations of atomic and molecular adsorptions on 55-atom metal clusters: Comparison with (1Â 1Â 1) surfaces Fulltext Access 5 Pages 2005
Study on electronic transport properties of WO3/TiO2 nanocrystalline thin films by photoassisted conductive atomic force microscopy Fulltext Access 5 Pages 2005
Second virial coefficients of water beyond the conventional first-order quantum correction Fulltext Access 5 Pages 2005
Magnetic properties and electron spin resonance of charge ordering manganite Y0.5Ca0.5MnO3 Fulltext Access 5 Pages 2005
Dielectric and dynamic mechanical properties of polyimide-clay nanocomposite films Fulltext Access 5 Pages 2005
Ordered water inside carbon nanotubes: formation of pentagonal to octagonal ice-nanotubes Fulltext Access 5 Pages 2005
Synthesis and characterization of S-doped ZnO nanowires produced by a simple solution-conversion process Fulltext Access 5 Pages 2005
A theoretical study of cyclohexadiene/hexatriene photochemical interconversion: multireference configuration interaction potential energy surfaces and transition probabilities for the radiationless decays Fulltext Access 5 Pages 2005
Cross-correlated relaxation evidence for the intramolecular C-Hâ¯N hydrogen bond in solution Fulltext Access 5 Pages 2005
A highly intense state-selected CH radical beam and its application to the CHÂ +Â O2 reaction Fulltext Access 5 Pages 2005
Cluster assistant multiply ionization of benzene by nanosecond laser: wavelength dependence of the production of highly charged carbon ions Fulltext Access 5 Pages 2005
Excitons in core LH1 antenna complexes of photosynthetic bacteria: Evidence for strong resonant coupling and off-diagonal disorder Fulltext Access 5 Pages 2005
Optical nonlinearity in glass-embedded silver nanoclusters under ultrafast laser excitation Fulltext Access 5 Pages 2005
The correlation between the molecular chirality of the sugar ring on the mesoscopic aggregate morphology in RNA and DNA mimetic systems Fulltext Access 5 Pages 2005
Infrared spectroscopy of Kr-12C18O2: Change in the CO2 intramolecular potential by complex formation and isotope effect on the vibrationally averaged intermolecular geometry Fulltext Access 5 Pages 2005
Water adsorption on O-covered Ru{0Â 0Â 0Â 1}: Coverage-dependent change from dissociation to molecular adsorption Fulltext Access 5 Pages 2005
Fluorescence emission from rhodamine-B lactone adsorbed at solid catalysts Fulltext Access 5 Pages 2005
Raman studies of rhodamine 6G and crystal violet sub-monolayers on electrochemically roughened silver substrates: Do dye molecules adsorb preferentially on highly SERS-active sites? Fulltext Access 5 Pages 2005
Kinetics study of the gas-phase reactions of CHF2CF2OCHF2 and CF3CHFCF2OCH2CF2CF3 with OH radicals at 253-328Â K Fulltext Access 5 Pages 2005
Solubilization-induced surface structural changes of sol particles observed by hyper Rayleigh scattering Fulltext Access 5 Pages 2005
The 17O hyperfine structure of trapped holes photo generated at the surface of polycrystalline MgO Fulltext Access 5 Pages 2005
Structures and isomerization of serine in aqueous solution: Computational study Fulltext Access 5 Pages 2005
Structure-activity relationship: the case of CO2 adsorption on H/Zn-ZnO(0Â 0Â 0Â 1) Fulltext Access 5 Pages 2005
Synthesis, characterization and properties of novel BN nanocages from a single-source precursor Fulltext Access 5 Pages 2005
The optimal size of a globular protein domain: A simple sphere-packing model Fulltext Access 5 Pages 2005
Photodissociation of o-C6H4I(CH2Cl) in the near ultraviolet: a case of photoselective C-I bond dissociation Fulltext Access 5 Pages 2005
Calculation of the optical rotatory dispersion of solvated alanine by means of the perturbed matrix method Fulltext Access 5 Pages 2005
Molecular electric conductance and long-bond structure counting for conjugated-carbon nano-structures Fulltext Access 5 Pages 2005
Concentration-dependence of photoluminescence properties in polythiophene diluted in an inactive polymer matrix Fulltext Access 5 Pages 2005
Doubly-excited 2s21Se resonance state of helium embedded in Debye plasmas Fulltext Access 5 Pages 2005
Theoretical study on all-metal aromatic complexes: all-metal aromatic hydrogen bond Fulltext Access 5 Pages 2005
Bond-based corrections to semi-empirical and ab initio electronic structure calculations Fulltext Access 5 Pages 2005
The correspondence between quantum and classical mechanics: an experimental demonstration of the smooth transition between the two regimes Fulltext Access 5 Pages 2005
Theoretical prediction of new noble-gas molecules OBNgF (Ng = Ar, Kr, and Xe) Fulltext Access 5 Pages 2005
How transparent are the imidazolium ionic liquids? A case study with 1-methyl-3-butylimidazolium hexafluorophosphate, [bmim][PF6] Fulltext Access 5 Pages 2005
Origin of the stretched-exponential hole relaxation in regioregular poly(3-hexylthiophene) Fulltext Access 5 Pages 2005
Operation lifetimes of organic light-emitting devices with different layer structures Fulltext Access 5 Pages 2005
Proton conductivity of zwitterionic-type molecular solids under intermediate temperature and anhydrous conditions Fulltext Access 5 Pages 2005
GeO2: Bi, M (M = Ga, B) glasses with super-wide infrared luminescence Fulltext Access 5 Pages 2005
Studies on the ion-association of methylene blue and salicylic acid in neat and mixed binary solvents Fulltext Access 5 Pages 2005
Femtosecond emission study of H-atom transfer reaction dynamics in a new system with an internal H-bond Fulltext Access 5 Pages 2005
Matrix computation of the statistical mechanics of a lattice model of multistep benzene adsorption isotherms in silicalite Fulltext Access 5 Pages 2005
First-principles study of ferroelectric and nonlinear optical property in bismuth titanate Fulltext Access 5 Pages 2005
Self-assembly of silver nano-particles on stearic acid Langmuir-Blodgett film: evidence of fractal growth Fulltext Access 5 Pages 2005
Dynamics and packing mode of long-chained n-alkane molecules in the nano-channel of MCM-41 Fulltext Access 5 Pages 2005
Efficient method to functionalize carbon nanotubes with thiol groups and fabricate gold nanocomposites Fulltext Access 5 Pages 2005
Kinetics of immobile adsorption of linear molecules on a two-dimensional lattice Fulltext Access 5 Pages 2005
Large three-photon absorption cross-section in a novel class of bis-(N-carbazolyl) fluorene derivatives Fulltext Access 5 Pages 2005
Single-source approach to the synthesis of In2S3 and In2O3 crystallites and their optical properties Fulltext Access 5 Pages 2005
Blue upconversion emission of Tm3+-Yb3+ in ZrO2 nanocrystals: Role of Yb3+ ions Fulltext Access 5 Pages 2005
On the coverage-dependent orientation of benzene adsorbed on Cu(1Â 0Â 0): A density functional theory study Fulltext Access 5 Pages 2005
Homolytic cleavage of C-Si bond of p-trimethylsilylmethylacetophenone upon stepwise two-photon excitation using two-color two-laser flash photolysis Fulltext Access 5 Pages 2005
Large optical third-order nonlinearity of composite thin film of carbon nanotubes and BaTiO3 Fulltext Access 5 Pages 2005
Treatments of non-nuclear attractors within the theory of atoms in molecules Fulltext Access 5 Pages 2005
Method for the evaluation of the reorganization energy of electron transfer reactions in water-methanol mixtures Fulltext Access 5 Pages 2005
Optical chirality of citronelloxy-cyanobiphenyl monolayer at an air-water interface studied by the MDC and SHG measurement Fulltext Access 5 Pages 2005
Anomalous behavior of a polymer chain in supercritical solvents: A remarkable expansion of solvophobic polymer Fulltext Access 5 Pages 2005
Optical-optical double resonance LIF measurement of N2(C3Πu, v = 2) deactivation rate constant by N2 collisions Fulltext Access 5 Pages 2005