Solid-state NMR characterization of diastereoisomeric chiral stationary phases and their soluble models Fulltext Access 11 Pages 2005
The use of multivariate MR imaging intensities versus metabolic data from MR spectroscopic imaging for brain tumour classification Fulltext Access 11 Pages 2005
Theoretical and experimental investigation of 13C relayed 2H-2H-COSY 2D experiments: Application to the analysis of weakly aligned solutes Fulltext Access 11 Pages 2005
Quantitative study of the effects of chemical shift tolerances and rates of SA cooling on structure calculation from automatically assigned NOE data Fulltext Access 11 Pages 2005
3D NMR spectroscopy for resonance assignment and structure elucidation of proteins under MAS: novel pulse schemes and sensitivity considerations Fulltext Access 11 Pages 2005
Electronic spectra of molecules with two C3v internal rotors: Torsional analysis of the AË1Au-XË1Ag LIF spectrum of biacetyl Fulltext Access 11 Pages 2005
Line shift and mixing in the ν4 and 2ν2 band of NH3 perturbed by H2 and Ar Fulltext Access 11 Pages 2005
Protein backbone dynamics from N-HN dipolar couplings in partially aligned systems: a comparison of motional models in the presence of structural noise Fulltext Access 11 Pages 2005
A multispectrum analysis of the ν2 band of H12C14N: Part II. Theoretical calculations of self-broadening, self-induced shifts, and their temperature dependences Fulltext Access 11 Pages 2005
Diode laser absorption spectroscopy measurement of linestrengths and pressure broadening coefficients of the methane 2ν3 band at elevated temperatures Fulltext Access 11 Pages 2005
Intensities and self-broadening coefficients of the CO2 Ro-vibrational transitions measured by a near-IR diode laser spectrometer Fulltext Access 11 Pages 2005
One-dimensional models of internal rotation in CX3NO molecules (XÂ =Â H, D, F) Fulltext Access 11 Pages 2005
Global analysis of 12CH335Cl and 12CH337Cl: simultaneous fit of the lower five polyads (0-2600Â cmâ1) Fulltext Access 11 Pages 2005
Vibrationally excited states of HC5N: millimeter-wave spectroscopy and coupled cluster calculations Fulltext Access 11 Pages 2005
Comparison of optical properties and crystal structures of the praseodymium and europium chloroderivatives of acetates Fulltext Access 12 Pages 2005
Geometry of multiple-spin systems as reflected in 13C-{1H} dipolar spectra measured at Lee-Goldburg cross-polarization Fulltext Access 12 Pages 2005
Site connectivities in silver borophosphate glasses: new results from 11B{31P} and 31P{11B} rotational echo double resonance NMR spectroscopy Fulltext Access 12 Pages 2005
A 125Te and 23Na NMR investigation of the structure and crystallisation of sodium tellurite glasses 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
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
FTIR studies of the CH3CN-BF3 complex in solid Ar, N2, and Xe: Matrix effects on vibrational spectra 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
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
Application of path integral formalism in spectral line broadening: Lyman-α in hydrogenic plasma 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
Non-ideal effects in organic-inorganic materials for gas separation membranes 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
Pyrolytic carbon membranes containing silica: morphological approach on gas transport behavior 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
Ground vs. excited state interaction in ruthenium-thienyl dyads: implications for through bond interactions in multicomponent systems 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
Generation of L sub-shell photo-ionization cross-sections for elements 18⩽Z⩽92 at energies .320-115.606 keV (A computer program 'LSPICS') Fulltext Access 12 Pages 2005
Effects of primary particle diameter and aggregate size distribution on the temperature of soot particles heated by pulsed lasers Fulltext Access 12 Pages 2005
Characterization of metallic nano-particles via surface wave scattering: A. Theoretical framework and formulation Fulltext Access 12 Pages 2005
Theoretical analysis of frequency and time-domain methods for optical characterization of absorbing and scattering media Fulltext Access 12 Pages 2005
Temporal analysis of reflected optical signals for short pulse laser interaction with nonhomogeneous tissue phantoms Fulltext Access 12 Pages 2005
Experimental and theoretical analyses on the microwave backscattering ability and differential radar reflectivity of non-spherical hydrometeors Fulltext Access 12 Pages 2005
New experimental data on the K2a3Σu+ state analyzed with the multi-parameter approach Fulltext Access 12 Pages 2005
Modeling of radiative heat transfer in an axisymmetric cylindrical enclosure with participating medium Fulltext Access 12 Pages 2005
Reconstruction optical spectroscopy using transient radiative transfer equation and pulsed laser: a numerical study Fulltext Access 12 Pages 2005
An efficient diffusion approximation for 3D radiative transfer parameterization: application to cloudy atmospheres 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
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
A semi-analytic technique to speed up successive order of scattering model for optically thick media 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
Transient heat transfer in a spherical protective material, submitted to flux and mixed boundary conditions: an investigation on zirconia Fulltext Access 12 Pages 2005
Numerical heat transfer study in a scattering, absorbing and emitting semi-transparent porous medium in a cylindrical enclosure Fulltext Access 12 Pages 2005
Noise reduction in X-ray photoelectron spectromicroscopy by a singular value decomposition sorting procedure Fulltext Access 12 Pages 2005
Spatially encoded NMR and the acquisition of 2D magnetic resonance images within a single scan Fulltext Access 12 Pages 2005
Rotor-synchronized acquisition of quadrupolar satellite-transition NMR spectra: practical aspects and double-quantum filtration Fulltext Access 12 Pages 2005
A theoretical investigation of 4fâ5d transition of trivalent rare earth ions in fluorides and complex oxides Fulltext Access 12 Pages 2005
Pressure-sensitive paint (PSP): concentration quenching of platinum and magnesium porphyrin dyes in polymeric films 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
A simulation algorithm based on Bloch equations and product operator matrix: application to dipolar and scalar couplings Fulltext Access 12 Pages 2005
Hydrogen bonds in 1-indanone: Charge density analysis and simulation of the inelastic neutron scattering spectrum in solid phase Fulltext Access 12 Pages 2005
Tunneling and resonant conductance in one-dimensional molecular structures Fulltext Access 12 Pages 2005
Synergetic mechanisms of structural regulation of the electron transfer and other reactions of biological macromolecules Fulltext Access 12 Pages 2005
Direct correlation functions and the density functional theory of polar solvents Fulltext Access 12 Pages 2005
Potential-induced structural transitions of DL-homocysteine monolayers on Au(1Â 1Â 1) electrode surfaces Fulltext Access 12 Pages 2005
Molecular assemblies and redox reactions of zinc(II) tetraphenylporphyrin and zinc(II) phthalocyanine on Au(1Â 1Â 1) single crystal surface at electrochemical interface Fulltext Access 12 Pages 2005
Molecular simulations of outersphere reorganization energies for intramolecular electron and hole transfer in polar solvents Fulltext Access 12 Pages 2005
Kinetic equations for exactly solvable models of a geminate reaction in the presence of scavengers 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
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
Excited state dynamics of a conformationally disordered conjugated polymer: A comparison of solutions and film 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
Multispin moments edited by multiple-quantum NMR: application to elastomers Fulltext Access 12 Pages 2005
Measuring 1H-1H and 1H-13C RDCs in methyl groups: example of pulse sequences with numerically optimized coherence transfer schemes Fulltext Access 12 Pages 2005
Determination of orientation distribution function of anisotropic paramagnetic species by analysis of ESR spectra angular dependence Fulltext Access 12 Pages 2005
A 13C field-cycling NMR relaxometry investigation of proton tunnelling in the hydrogen bond: Dynamic isotope effects, the influence of heteronuclear interactions and coupled relaxation Fulltext Access 12 Pages 2005
Temperature dependence of the 1H chemical shift of tetramethylsilane in chloroform, methanol, and dimethylsulfoxide Fulltext Access 12 Pages 2005
Spin-edited 2D HSQC-TOCSY experiments for the measurement of homonuclear and heteronuclear coupling constants: Application to carbohydrates and peptides Fulltext Access 12 Pages 2005
An advanced EPR stopped-flow apparatus based on a dielectric ring resonator Fulltext Access 12 Pages 2005