Applications, magnetic properties

Within the periodic Hartree-Fock approach it is possible to incorporate many of the variants that we have discussed, such as LFHF or RHF. Density functional theory can also be used. I his makes it possible to compare the results obtained from these variants. Whilst density functional theory is more widely used for solid-state applications, there are certain types of problem that are currently more amenable to the Hartree-Fock method. Of particular ii. Icvance here are systems containing unpaired electrons, two recent examples being the clci tronic and magnetic properties of nickel oxide and alkaline earth oxides doped with alkali metal ions (Li in CaO) [Dovesi et al. 2000]. 

Magnetic Applications. MetaUic glasses ate utilized ia electric transformers and this provides a significant commercial success for these materials. AUoys such as MetGlas 2605 SC, Feg B 5 i3 5 2 prepared ia sheets having superior soft magnetic properties. These alloys can be magnetized... 

Any difference in physical properties of the individual solids can be used as the basis for separation. Differences in density size, shape, color, and electrical and magnetic properties are used in successful commercial separation processes. An important factor in determining the techniques that can be prac tically applied is the particle-size range of the mixture. A convenient guide to the application of different solid-solid separation techniques in relation to the particle-size range is presented in Fig. 19-1, which is a modification of an original illustration by Roberts et al. 

Thin-film XRD is important in many technological applications, because of its abilities to accurately determine strains and to uniquely identify the presence and composition of phases. In semiconduaor and optical materials applications, XRD is used to measure the strain state, orientation, and defects in epitaxial thin films, which affect the film s electronic and optical properties. For magnetic thin films, it is used to identify phases and to determine preferred orientations, since these can determine magnetic properties. In metallurgical applications, it is used to determine strains in surfiice layers and thin films, which influence their mechanical properties. For packaging materials, XRD can be used to investigate diffusion and phase formation at interfaces... 

From the applications of Ni Mossbauer spectroscopy in solid-state research, it is clear that (1) information from isomer shift studies is generally not very reliable because of the smallness of the observed isomer shifts and the necessity of SOD shift corrections which turn out to be difficult, and (2) useful information about magnetic properties and site symmetry is obtained from spectra reflecting magnetic and/or quadrupolar interactions. 

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