Vibrational Spectroscopy of Minerals through Ab Initio Methods

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Vibrational Spectroscopy of Minerals through Ab Initio Methods

This chapter provides examples that demonstrate the usefulness of ab initio (first principles) simulation in analysing the lattice dynamics and vibrational spectroscopic response of minerals. It focuses on the details of vibrational spectroscopies, namely, infrared, Raman and related techniques, as...

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Bibliographic Details
Main Authors:	de la Pierre, Marco, Demichelis, Raffaella, Dovesi, R.
Format:	Book Chapter
Published:	2016
Online Access:	http://hdl.handle.net/20.500.11937/51335

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