The crystal field interaction at the rare earth site in ErNiAl(4).

Inelastic neutron scattering spectra are reported for orthorhombic ErNiAl(4) at temperatures ranging from 2.1 to 280 K. The neutron transitions are interpreted in terms of three reliably identified excited crystal field (CF) levels and four tentative excited levels for the J = 7/2 ground term of Er(3+) at the single Er site. A shift in transition peak energy between 2.1 and 8.6 K is attributed to Zeeman splitting induced by magnetic order of the Er sub-lattice below T(N) = 5.8 K. With the aid of a suite of possible (155)Gd-Mössbauer spectroscopy derivations of the rank n = 2 CF parameters and a simple point charge model calculation of within-rank ratios for the higher rank (n = 4,6) parameters, estimates are made for all nine CF parameters required for the orthorhombic C(2v) (mm) Er-site symmetry.

The effect of hydration on protein flexibility in photosystem II of green plants studied by quasielastic neutron scattering.

The effect of hydration on protein dynamics in photosystem II (PS II) membrane fragments from spinach has been investigated by using the method of quasielastic neutron scattering (QENS) at room temperature. The QENS data obtained indicate that the protein dynamics is strongly dependent on the extent of hydration. In particular, the hydration-induced activation of localized diffusive protein motions and QA- reoxidation by QB in PS II appear to be correlated in their onset at a hydration value of about 45% relative humidity (r.h.). These findings underline the crucial functional relevance of localized diffusive protein motions on the picosecond-timescale for the reactions of light-induced photosynthetic water splitting under formation of plastoquinol and molecular oxygen in PS II of green plants.

Quasielastic neutron scattering experiments including activation energies and mathematical modeling of methyl halide dynamics.

Quasielastic neutron scattering experiments were carried out using the multichopper time-of-flight spectrometer V3 at the Hahn-Meitner Institut, Germany and the backscattering spectrometer at Forschungszentrum Julich, Germany. Activation energies for CH(3)X, X=F, Cl, Br, and I, were obtained. In combination with results from previous inelastic neutron scattering experiments the data were taken to describe the dynamics of the halides in terms of two different models, the single particle model and the coupling model. Coupled motions of methyl groups seem to explain the dynamics of the methyl fluoride and chloride; however, the coupling vanishes with the increase of the mass of the halide atom in CH(3)Br and CH(3)I.