On the lattice dynamics of AgGaS2 |
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Authors: | V G Tyuterev S I Skachkov |
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Institution: | (1) Siberian Physical-Technical Institute, Tomsk, Russia;(2) Research Institute of Building Materials, Tomsk, Russia |
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Abstract: | Summary The vibrational spectrum and one-phonon density of states of a chalcopyrite crystal AgGaS2 are calculated in an extended Keating’s model with two-bond-stretching and one-bond-bending force constants. Three charges
of ions and three force constants are determined by a least-square fitting to experimental frequencies of long-wave phonons
taken from Raman-scattering experiments. The calculated constant-volume specific heat, Debye temperature and elastic constants,
of AgGaS2 are in agreement with the experimental data of other authors. |
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Keywords: | Phonons and vibrations in crystal lattices |
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