Photoinduced electron transfer in fullerene triads bearing pyrene and fluorene Fulltext Access 9 Pages 2006
The importance of a hot-sequential mechanism in triplet-state formation by charge recombination in reaction centers of bacterial photosynthesis Fulltext Access 9 Pages 2006
Physically based molecular device model in a transient circuit simulator Fulltext Access 9 Pages 2006
Characterization of infrared vibrational activity in specific totally symmetric bridging modes of mixed-valence systems near the localized-to-delocalized transition Fulltext Access 9 Pages 2006
Measurement of the driving force dependence of interfacial charge-transfer rate constants in response to pH changes at n-ZnO/H2O interfaces Fulltext Access 9 Pages 2006
On the geometry dependence of molecular dimer spectra with an application to aggregates of perylene bisimide Fulltext Access 9 Pages 2006
CO adsorption on CeO2(1Â 1Â 0) using hybrid-DFT embedded-cluster calculations Fulltext Access 9 Pages 2006
Time-dependent density functional theory determination of the absorption spectra of naphthoquinones Fulltext Access 9 Pages 2006
Conformational equilibria in EE-1,3-di-(3â²-thienylethenyl)benzene: One-way adiabatic interconversion of rotamers in S1 and their excited state properties Fulltext Access 9 Pages 2006
Interaction of a supersonic NO beam with static and resonant RF fields: Simple theoretical model to account for molecular interferences Fulltext Access 9 Pages 2006
A new expression for radial distribution function and infinite shear modulus of Lennard-Jones fluids Fulltext Access 9 Pages 2006
Space-time symmetry elements in molecular quantum mechanics: The hydrogen bond Fulltext Access 9 Pages 2006
The role of oxidation states in FA1 Tln+ (n = 1, 3) lasers and CO interactions at the (1 0 0) surface of NaCl: An ab initio study Fulltext Access 9 Pages 2006
Multiconfiguration SCF electric field gradients in (NO)2 and its singly charged ions Fulltext Access 9 Pages 2006
Dynamics of complex molecular systems with numerical kinetic energy operators in generalized coordinates Fulltext Access 9 Pages 2006
Quasielastic and inelastic neutron scattering study of the hydration of monoclinic and triclinic tricalcium silicate Fulltext Access 9 Pages 2006
Theoretical study of adducts of dimethyl sulfide with hydroperoxyl and hydroxyl radicals Fulltext Access 9 Pages 2006
Role of the recoil effect in two-center interference in X-ray photoionization Fulltext Access 9 Pages 2006
Free tetra- and hexa-coordinated platinum-cyanide dianions, Pt(CN)42- and Pt(CN)62-: A combined photodetachment photoelectron spectroscopic and theoretical study Fulltext Access 9 Pages 2006
Cleavage of thymine N3-H bonds by low-energy electrons attached to base Ïâ orbitals Fulltext Access 9 Pages 2006
Classical description of the dynamics and time-resolved spectroscopy of nonadiabatic cis-trans photoisomerization Fulltext Access 9 Pages 2006
Vibronic coupling in square planar complexes of palladium(II) and platinum(II) Fulltext Access 9 Pages 2006
Multidimensional infrared spectroscopy of a peptide intramolecular hydrogen bond Fulltext Access 9 Pages 2006
The effect of preadsorbed K on the size distribution of Au nanoparticles on TiO2(1 1 0) surface Fulltext Access 9 Pages 2006
A semi-empirical study of polyacene molecules adsorbed on a Cu(1 1 0) surface Fulltext Access 9 Pages 2006
Photoemission, NEXAFS and STM studies of pentacene thin films on Au(1Â 0Â 0) Fulltext Access 9 Pages 2006
Free energy perturbation and dynamical nucleation study of water dimer and trimer through TIP5P water model Fulltext Access 9 Pages 2006
Excited state properties of novel p- and n-type organic semiconductors with an anthracene unit Fulltext Access 9 Pages 2006
C2H6 scattering from LiF(0Â 0Â 1): Influence of the molecular anisotropy on rainbow scattering in both intensity and speed distributions Fulltext Access 9 Pages 2006
Photoinduced intramolecular charge transfer (ICT) reaction in trans-methyl p-(dimethylamino) cinnamate: A combined fluorescence measurement and quantum chemical calculations Fulltext Access 9 Pages 2006
Characterization of conformers of non-ionized proline on the basis of topological and NBO analyses: Can nitrogen be a donor of hydrogen bond? Fulltext Access 9 Pages 2006
A first principles study of the binding of formic acid in catalase complementing high resolution X-ray structures Fulltext Access 9 Pages 2006
Correlation of early orientational ordering of engineered λ6-85 structure with kinetics and thermodynamics Fulltext Access 9 Pages 2006
Nonequilibrium molecular dynamics simulation of a photoswitchable peptide Fulltext Access 9 Pages 2006
Nonequilibrium protein folding dynamics: laser-induced pH-jump studies of the helix-coil transition Fulltext Access 9 Pages 2006
Dynamics of the quantum Duffing oscillator in the driving induced bistable regime Fulltext Access 9 Pages 2006
On the computation of imaginary-time correlation functions beyond the âβ limit Fulltext Access 9 Pages 2006
Spectral, kinetic and polarization characteristics of luminescence of acriflavine in polymeric matrix under pulsed excitation with different durations and intensities Fulltext Access 9 Pages 2006
Influences of the molecule-electrode interface structure on the conducting characteristics of the gold-4,4 bipyridine-gold molecular junction Fulltext Access 9 Pages 2006
Thermo-stimulated surface segregation in the ordering alloy Pt80Co20(1 1 1): Experiment and modeling Fulltext Access 9 Pages 2006
Coadsorption of CN and O on Cu (1 0 0) surface: A density functional study Fulltext Access 9 Pages 2006
Electron energy loss spectra from polycrystalline Cr and Cr2O3 before and after surface reduction by Ar+ bombardment Fulltext Access 9 Pages 2006
Surface modification by oil jet peening in Al alloys, AA6063-T6 and AA6061-T4: Part 2: Surface morphology, erosion, and mass loss Fulltext Access 9 Pages 2006
Implication of the role of oxygen anions and oxygen vacancies for methanol decomposition over zirconia supported copper catalysts Fulltext Access 9 Pages 2006
Fundamental processes of aluminium corrosion studied under ultra high vacuum conditions Fulltext Access 9 Pages 2006
Potential dependence of cuprous/cupric duplex film growth on copper electrode in alkaline media Fulltext Access 9 Pages 2006
RETRACTED: Superior refractive index tailoring properties in composite ZrO2/SiO2 thin film systems achieved through reactive electron beam codeposition process Fulltext Access 9 Pages 2006
Ammonia adsorption and decomposition on silica supported Rh nanoparticles observed by in situ attenuated total reflection infrared spectroscopy Fulltext Access 9 Pages 2006
The effect of pH and role of Ni2+ in zinc phosphating of 2024-Al alloy: Part I: Macroscopic studies with XPS and SEM Fulltext Access 9 Pages 2006
Influence of transition metals (Cr, Mn, Fe, Co and Ni) on the methane combustion over Pd/Ce-Zr/Al2O3 catalyst Fulltext Access 9 Pages 2006
Synthesis and characterization of corrosion protective poly(2,5-dimethylaniline) coatings on copper Fulltext Access 9 Pages 2006
1064-nm laser fragmentation of thin Au and Ag flakes in acetone for highly productive pathway to stable metal nanoparticles Fulltext Access 9 Pages 2006
Stabilization of discotic liquid organic thin films by ITO surface treatment Fulltext Access 9 Pages 2006
Substrate effects on the oxygen gas sensing properties of SnO2/TiO2 thin films Fulltext Access 9 Pages 2006
Structural, morphological, wettability and thermal resistance properties of hydro-oleophobic thin films prepared by a wet chemical process Fulltext Access 9 Pages 2006
RETRACTED: Analysis of codeposited Gd2O3/SiO2 composite thin films by phase modulated spectroscopic ellipsometric technique Fulltext Access 9 Pages 2006
Temperature and N+ energy dependence on nano-structural modifications and characteristics of Mo surface Fulltext Access 9 Pages 2006
Influence of epitaxial strain on the terrace and inter-layer diffusions in metal epitaxy Fulltext Access 9 Pages 2006
Correlation between optical properties and Si nanocrystal formation of Si-rich Si oxide films prepared by plasma-enhanced chemical vapor deposition Fulltext Access 9 Pages 2006
Surface roughening and erosion rate change at low energy SIMS depth profiling of silicon during oblique O2+ bombardment Fulltext Access 9 Pages 2006
High temperature annealing effect on structural and magnetic properties of Ti/Ni multilayers Fulltext Access 9 Pages 2006
Structure and spectral studies of the BEDO-TTF radical cation salt with isocyanuric acid anion Fulltext Access 9 Pages 2006
First-order correction for bond energy applied to polar molecules: Alkali halides, alkali cyanides, LiCH3, and CH3F Fulltext Access 9 Pages 2006
Reaction of the 2-hydroxy-2-propyl radical with acrylate type molecules in aqueous solution: Radical addition or electron transfer Fulltext Access 9 Pages 2006
The nuclear quadrupole interaction at inequivalent lattice sites in ammonium paramolybdate: A TDPAC study Fulltext Access 9 Pages 2006
Electron momentum spectroscopy study of thiophene: Binding energy spectrum and valence orbital electron density distributions Fulltext Access 9 Pages 2006
A comparative study of YBa2Cu4O8 (Y-124) superconductors prepared by a sol-gel method Fulltext Access 9 Pages 2006
Theoretical study of Hal3CH/F2CD2 (Hal = F, Cl) and F3CH/FH heterodimers with blue shifted hydrogen bonds Fulltext Access 9 Pages 2006
An ab initio model for handling the Renner-Teller effect in tetra-atomic molecules. II. Study of the crossing of potential surfaces Fulltext Access 9 Pages 2006
Effect of stereoisomerism on the radiative and reactive relaxation channels of two thio-analogues of distyrylbenzene Fulltext Access 9 Pages 2006
Kinetics of the CH3 + HCl/DCl â CH4/CH3D + Cl and CD3 + HCl/DCl â CD3H/CD4 + Cl reactions: An experimental H atom tunneling investigation Fulltext Access 9 Pages 2006
Gas-phase Boudouard disproportionation reaction between highly vibrationally excited CO molecules Fulltext Access 9 Pages 2006
Comparative studies of Zr-based MCM-41 and MCM-48 mesoporous molecular sieves: Synthesis and physicochemical properties Fulltext Access 9 Pages 2006
1,3,6,8-Tetraethynylpyrene and 1,3,6,8-tetrakis (trimethylsilylethynyl) pyrene: Photophysical properties in homogeneous media Fulltext Access 9 Pages 2006
Effects of cation siting and spin-spin interactions on the electron paramagnetic resonance (EPR) of Cu2+ exchanged X Faujasite zeolite Fulltext Access 9 Pages 2006
Monolayer characteristics of stereoregular PMMA at the air/water interface Fulltext Access 9 Pages 2006
Surface chemical modification of TEOS based silica aerogels synthesized by two step (acid-base) sol-gel process Fulltext Access 9 Pages 2006
Influence of oxidation time on semiconductive behaviour of thermally grown oxide films on AISI 304L Fulltext Access 9 Pages 2006
In situ monitoring of bare and K-doped Mo2C catalysts surface depassivation based on emission of electrons and K+ ions Fulltext Access 9 Pages 2006
Experimental and theoretical study for corrosion inhibition of mild steel in hydrochloric acid solution by some new hydrazine carbodithioic acid derivatives Fulltext Access 9 Pages 2006
Effect of energy distribution of interface states on the electrical characteristics of semiconductor heterojunction diode Fulltext Access 9 Pages 2006
The effect of some Schiff bases on the corrosion of aluminum in hydrochloric acid solution Fulltext Access 9 Pages 2006
Two-dimensional recrystallisation processes of nanometric vanadium oxide thin films grown by atomic layer chemical vapor deposition (ALCVD) evidenced by AFM Fulltext Access 9 Pages 2006