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...
| Main Authors: | , , |
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| Format: | Book Chapter |
| Published: |
2016
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| Online Access: | http://hdl.handle.net/20.500.11937/51335 |