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- W2004343916 abstract "Lattice dynamics simulation of CsD2PO4 crystal is performed in a quasiharmonic approximation using the atomistic potential involving Coulomb, short-range, covalent, van der Waals and hydrogen-bonded interactions. The phonon dispersion relations, partial density of states, velocities of ultrasonic waves and atomic displacement parameters are calculated both in the paraelectric and ferroelectric phases. The obtained data enable us to give a detailed description of the observed Raman and IR spectra and to determine the eventual local symmetry of the PO4 groups. (© 2007 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim)" @default.
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- W2004343916 date "2007-02-01" @default.
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- W2004343916 title "On the vibrational properties of CsD2PO4 crystal" @default.
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- W2004343916 doi "https://doi.org/10.1002/pssb.200642176" @default.
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