Smooth etching of silicon using TMAH and isopropyl alcohol for MEMS applications Fulltext Access 12 Pages 2005
Infrared and Raman spectroscopy and quantum chemistry calculation studies of C-Hâ¯O hydrogen bondings and thermal behavior of biodegradable polyhydroxyalkanoate Fulltext Access 12 Pages 2005
FTIR studies of the CH3CN-BF3 complex in solid Ar, N2, and Xe: Matrix effects on vibrational spectra Fulltext Access 12 Pages 2005
peri-Interactions in naphthalenes, 13 [1] 8-Dimethylamino-naphth-1-yl carbinols as model systems for potential NâSi/P interactions Fulltext Access 12 Pages 2005
Two polymorphs of 4-hydroxy-1-methylpiperidine betaine hydrochloride studied by X-ray and DFT methods Fulltext Access 12 Pages 2005
Crystal structure and EPR studies of (cinchonineH2)2(CdCl4)(Cd/CuCl4) crystals with thermochromic and Jahn-Teller effect Fulltext Access 12 Pages 2005
Copper(II) complexes with tridentate N-(benzoyl)-Nâ²-(salicylidine)-hydrazine and monodentate N-heterocycles: Investigations of intermolecular interactions in the solid state Fulltext Access 12 Pages 2005
Synthesis, thermogravimetric analysis, infrared, electronic and mass spectra of Mn(II), Co(II) and Fe(III) norfloxacin complexes Fulltext Access 12 Pages 2005
Laser Doppler instrument to investigate retinal neural activity-induced changes in optic nerve head blood flow Fulltext Access 12 Pages 2005
Structured light illumination for extended resolution in fluorescence microscopy Fulltext Access 12 Pages 2005
Tuneable, stabilised diode lasers for compact atomic frequency standards and precision wavelength references Fulltext Access 12 Pages 2005
A multispectrum analysis of widths and shifts in the 2010-2260Â cmâ1 region of 12C16O broadened by Helium at temperatures between 80 and 297Â K Fulltext Access 12 Pages 2005
Theoretical study of malonamide and nitromalonamide in vacuum and in water solution Fulltext Access 12 Pages 2005
DFT normal coordinate analysis of the vibrational spectra of iron and germanium corroles Fulltext Access 12 Pages 2005
On the regioselective mechanism of novel rearrangements of 1,6-enynes catalyzed by PtCl2: a DFT study Fulltext Access 12 Pages 2005
Hartree-Fock and density functional theory calculations for the reaction mechanism of nitric oxide reductase cytochrome P450nor from Fusarium oxysporum Fulltext Access 12 Pages 2005
A TDDFT study of the low-lying excitation energies of polycyclic cinnolines and their carbocyclic analogues Fulltext Access 12 Pages 2005
Ab initio and DFT gas phase investigations of the C7H11+ potential energy surfaces of bicyclobutonium species and related carbocations Fulltext Access 12 Pages 2005
Comparative protein modeling of methionine S-adenosyltransferase (MAT) enzyme from Mycobacterium tuberculosis: a potential target for antituberculosis drug discovery Fulltext Access 12 Pages 2005
Spectroscopic properties of Er3+-doped PbO-Ga2O3-GeO2 glass for optical amplifiers Fulltext Access 12 Pages 2005
Analysis by speckle interferometry of the dependency of yield stress on residual stress Fulltext Access 12 Pages 2005
Determination of the optical second harmonic response of pharmaceutical solid-solid mixtures Fulltext Access 12 Pages 2005
Characterization of Kovar-to-Kovar laser welded joints and its mechanical strength Fulltext Access 12 Pages 2005
Scanning moiré and spatial-offset phase-stepping for surface inspection of structures Fulltext Access 12 Pages 2005
Experimental results of the performance of a laser fiber as a remote sensor of temperature Fulltext Access 12 Pages 2005
Precise etching of fused silica for refractive and diffractive micro-optical applications Fulltext Access 12 Pages 2005
Inspecting verticality of cylindrical workpieces via multi-vision sensors based on structured light Fulltext Access 12 Pages 2005
Principles and realization of a novel instrument for high performance displacement measurement-nanometer laser ruler Fulltext Access 12 Pages 2005
Limit analysis for laser removal of micron contaminant colloidal silicon dioxide particles from the super-smooth optical glass substrate by pulse Nd:YAG laser Fulltext Access 12 Pages 2005
The electronic structural information from core orbitals of norbornadiene, norbornene and norbornane Fulltext Access 12 Pages 2005
Cluster analysis and three-dimensional QSAR studies of HIV-1 integrase inhibitors Fulltext Access 12 Pages 2005
Direct determination of reaction paths and stationary points on potential of mean force surfaces Fulltext Access 12 Pages 2005
Similarities among receptor pockets and among compounds: Analysis and application to in silico ligand screening Fulltext Access 12 Pages 2005
Synthesis and characterisation of tetrazole compounds: 3 series of new ligands representing versatile building blocks for iron(II) spin-crossover compounds Fulltext Access 12 Pages 2005
Ground vs. excited state interaction in ruthenium-thienyl dyads: implications for through bond interactions in multicomponent systems Fulltext Access 12 Pages 2005
Using artificial neural networks to develop molecular mechanics parameters for the modelling of metalloporphyrins. III. Five coordinate Zn(II) porphyrins and the metalloprophyrins of the early 3d metals Fulltext Access 12 Pages 2005
Pyrolytic carbon membranes containing silica: morphological approach on gas transport behavior Fulltext Access 12 Pages 2005
Non-ideal effects in organic-inorganic materials for gas separation membranes Fulltext Access 12 Pages 2005
Effects on sorption and diffusion in PTMSP and TMSP/TMSE copolymers of free volume changes due to polymer ageing Fulltext Access 12 Pages 2005
Comparison of optical properties and crystal structures of the praseodymium and europium chloroderivatives of acetates Fulltext Access 12 Pages 2005
Calculation of 19F NMR chemical shifts in uranium complexes using density functional theory and pseudopotentials Fulltext Access 12 Pages 2005
Self-assembling of ion-containing polymers and surfactants in aqueous solutions studied by ESR and fluorescence probes Fulltext Access 12 Pages 2005
Volumetric and thermal properties of some aqueous electrolyte solutions Fulltext Access 12 Pages 2005
Supramolecular structure and physicochemical properties of the trichloromethane-methanol mixtures Fulltext Access 12 Pages 2005
Performance and application of a high energy monochromated Cu Kα1 X-ray source for the electron spectroscopy of materials Fulltext Access 12 Pages 2005
Space charge effect and mirror charge effect in photoemission spectroscopy Fulltext Access 12 Pages 2005
Photoionization studies of the atmospherically important species N and OH at the Elettra synchrotron radiation source Fulltext Access 12 Pages 2005
Noise reduction in X-ray photoelectron spectromicroscopy by a singular value decomposition sorting procedure Fulltext Access 12 Pages 2005
Topological analysis of the electron density and of the electron localization function of pyrene and its radicals Fulltext Access 12 Pages 2005
Influence of van der Waals wells on the quantum scattering dynamics of the Cl(2P) + HCl â ClH + Cl(2P) reaction Fulltext Access 12 Pages 2005
Microscopic modelling of the reduction of a Zn(II) aqua-complex on metal electrodes Fulltext Access 12 Pages 2005
Vibrational spectra of methyllithium and its aggregates: a new interpretation from ab initio anharmonic calculations Fulltext Access 12 Pages 2005
Relativistic effects on experimentally studied gas-phase properties of the heaviest elements Fulltext Access 12 Pages 2005
The methane Raman spectrum from 1200 to 5500Â cmâ1: A first step toward temperature diagnostic using methane as a probe molecule in combustion systems Fulltext Access 12 Pages 2005
Quantum-chemical insight into the design of molecular optoelectrical switch Fulltext Access 12 Pages 2005
Potential energy surface survey towards prediction of a new radical [H2,Si,C,N] Fulltext Access 12 Pages 2005
UV/Vis/NIR spectral properties of triarylamines and their corresponding radical cations Fulltext Access 12 Pages 2005
Application of the encounter theory to the description of degenerate electron exchange reactions: spin kinetics at low magnetic fields Fulltext Access 12 Pages 2005
Theoretical study of anharmonic vibrational spectra of HNO3, HNO3-H2O, HNO4: Fundamental, overtone and combination excitations Fulltext Access 12 Pages 2005
Primary events in the bacteriorhodopsin photocycle: Torsional vibrational dephasing in the first excited electronic state Fulltext Access 12 Pages 2005
Theoretical and spectroscopic studies of pyridyl substituted bis-coumarins and their new neodymium (III) complexes Fulltext Access 12 Pages 2005
A combined spectroscopic and theoretical study of oxo- and thiono-sparteines Fulltext Access 12 Pages 2005
Theoretical description of copper Cu(I)/Cu(II) complexes in mixed ammine-aqua environment. DFT and ab initio quantum chemical study Fulltext Access 12 Pages 2005
Mathematical functions for the analysis of luminescence decays with underlying distributions 1. Kohlrausch decay function (stretched exponential) Fulltext Access 12 Pages 2005
A theoretical study on the sugars' mutarotation: the epimerisation of 2-tetrahydropyranol catalysed by formamidine, benzamidine and by the 2-aminopyridine/2-iminopyridine tautomeric couple Fulltext Access 12 Pages 2005
Electronic structure properties of fluorene-phenylene monomer and its derivatives: TD-DFT study Fulltext Access 12 Pages 2005
Analysis of competing bonding parameters. Part 2. The structure of halosilanes and halogermanes (MH4ânXn, n=1-4; M=Si, Ge; X=F, Cl, Br) Fulltext Access 12 Pages 2005
Comprehensive conformational analysis of N-acetyl-l-tryptophane-N-methylamide. An ab initio and DFT study Fulltext Access 12 Pages 2005
The theoretical calculations of vibrational spectra of guanidine selenate and guanidinium sulphate. Determination of direction of transition dipole moments by two methods: oriented gas model and changes in displacement eigenvectors computed by DFT method Fulltext Access 12 Pages 2005
Quantum chemistry-based interpretations on the lowest triplet state of luminescent lanthanides complexes. Part 2. Influence of the electrostatic interactions on the triplet state energy of terbium complexes Fulltext Access 12 Pages 2005
Ab initio study of intra- and intermolecular H-bond energies in Ï-conjugated molecular systems Fulltext Access 12 Pages 2005
Mechanism of thiophene hydrodesulfurization on a Mo3S9 model catalyst. A computational study Fulltext Access 12 Pages 2005
Study of peptide oligomer derived from HIV-1 integrase molecular modelling Fulltext Access 12 Pages 2005
Extension of the MST model to the IEF formalism: HF and B3LYP parametrizations Fulltext Access 12 Pages 2005
Molecular geometry, electronic structure and optical properties study of meridianal tris(8-hydroxyquinolinato)gallium(III) with ab initio and DFT methods Fulltext Access 12 Pages 2005
An experimental and theoretical study of the photoelectron spectrum of hydrogen selenide Fulltext Access 12 Pages 2005
Experimental determination of air-broadening parameters of pure rotational transitions of HNO3: intercomparison of measurements by using different techniques Fulltext Access 12 Pages 2005
Fourier transform emission spectroscopy of Îv = 2 sequence bands of the CO molecule in the ground electronic state Fulltext Access 12 Pages 2005
High-resolution rotational analysis of HDS: 2ν3, ν2 + 2ν3, 3ν3, and ν2 + 3ν3 bands Fulltext Access 12 Pages 2005
Microwave and high resolution infrared spectra of vinyl chloride, ab initio anharmonic force field and equilibrium structure Fulltext Access 12 Pages 2005
New experimental data on the K2a3Σu+ state analyzed with the multi-parameter approach Fulltext Access 12 Pages 2005
Intracavity laser absorption spectroscopy of HDO between 11Â 645 and 12Â 330Â cmâ1 Fulltext Access 12 Pages 2005
The ν1 and ν4 fundamental bands of H3Si37Cl investigated with high resolution Fulltext Access 12 Pages 2005
S0 and S1 spectroscopy of jet cooled 9-cyano-10-methylanthracene: The methyl group as a molecular rotor Fulltext Access 12 Pages 2005