The transverse acoustic excitation modes were detected by inelastic x-ray scattering in liquid Ga in the Q range above 9 nm(-1) although liquid Ga is mostly described by a hard-sphere liquid. An ab initio molecular dynamics simulation clearly supports this finding. From the detailed analysis for the S(Q,omega) spectra with a good statistic quality, the lifetime of 0.5 ps and the propagating length of 0.4-0.5 nm can be estimated for the transverse acoustic phonon modes, which may correspond to the lifetime and size of cages formed instantaneously in liquid Ga.
This paper gives a survey of the particle dynamics in the liquid alkali metals observed with inelastic x-ray and neutron scattering experiments. Liquid rubidium and sodium are chosen as model fluids to represent the behaviour of this group of fluids. In the dense metallic monatomic melt the microscopic dynamics is characterized by collective excitations similar to those in the corresponding solids. The collective particle behaviour is appropriately described using a memory function formalism with two relaxation channels for the density correlation. A similar behaviour is found for the single particle motion where again two relaxation mechanisms are needed to accurately reproduce the experimental findings. Special emphasis is given to the density dependence of the particle dynamics. An interesting issue in liquid metals is the metal to non-metal transition, which is observed if the fluid is sufficiently expanded with increasing temperature and pressure. This causes distinct variations in the interparticle interactions, which feed back onto the motional behaviour. The associated variations in structure and dynamics are reflected in the shape of the scattering laws. The experimentally observed features are discussed and compared with simple models and with the results from computer simulations.
Transverse acoustic (TA) excitation modes were observed in inelastic x-ray scattering (IXS) spectra of liquid Sn. The excitation energies and widths of the TA modes are in good agreement with results of an ab initio molecular dynamics simulation. By comparing current correlation spectra between the experimental and theoretical results quantitatively, we have concluded that the TA modes can be detected experimentally through the quasi-TA branches in the longitudinal current correlation spectra. The lifetime and propagation length of the TA modes were determined to be ~0.7 ps and 0.8-1.0 nm, respectively, corresponding to the size of cages formed instantaneously in liquid Sn.
The phase behaviour and thermotropic and barotropic phase transitions of different model biomembranes (DPPC, DMPC, DEPC and POPC*)), which consist of different hydrocarbon chain length and degree of unsaturation, have been investigated by small‐angle neutron scattering (SANS) as a function of temperature and pressure up to about 65°C and 3 kbar, respectively. A pressure induced structural phase transition from a liquid‐crystalline to a gel state is observed for the whole temperature range studied. The pressure of this transition increases with increasing temperature with a slope dTm/dP of about 21°C/kbar, which is common for all the different lipids investigated. The SANS experiments indicate that the effect of the two trans double bonds in DEPC and the cis double bond in the sn‐2 hydrocarbon chain of POPC enhances the conformational disorder in the hydrocarbon chains not only in the liquid‐crystalline, but also in the gel state. For DEPC and POPC the prefered structural conformation in the gel state is probably not tilted as it is in the gel state of the saturated phospholipids DMPC and DPPC. Only for DPPC multilamellar vesicles, an additional gel phase at higher pressures has been observed, which can be ascribed to an interdigitation of the hydrocarbon chains of opposing chains in the lipid bilayer system.
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