0000000000143135
AUTHOR
W. Pannhorst
Single particle jumps and correlated ionic motions in glass-ceramics
Using impedance spectroscopy, the ion transport in poorly Li-conducting aluminosilicate glass ceramics and their precursor glasses has been measured for temperatures 50 K < T < 550 K and covering a frequency range of more than 14 decades from 10 mHz up to 3 THz. In addition to the familiar cooperative ionic motion dominating at high temperatures, for the first time dielectric relaxation due to elementary hopping processes is observed well below room temperature.
On the interpretation of the experimental Raman spectrum of β-eucryptite LiAlSiO4 from atomistic computer modeling
Abstract The vibrational spectrum of β-eucryptite LiAlSiO4 with stuffed high quartz structure – commercially relevant for zero-expansion glass ceramics – was calculated by lattice energy minimization and diagonalization of the dynamical matrix using an ab initio based ion-pair shell model potential. A full symmetry analysis of the vibrational modes was carried out. Raman activity of vibrations was calculated under parameterization of individual polarizability factors for each type of interatomic bonds in β-eucryptite LiAlSiO4. Calculated vibrational energies agree with the experimental energies within ±2.3%. Agreement of calculated spectroscopic Raman intensities with experimental intensiti…