Anharmonic Effects on the Thermodynamic Properties of Quartz from First Principles Calculations

The simple chemistry and structure of quartz together with its abundance in nature and its piezoelectric properties make convenient its employment for several applications, from engineering to Earth sciences. For these purposes, the quartz equations of state, thermoelastic and thermodynamic properti...

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Bibliographic Details
Main Authors: Mara Murri, Mauro Prencipe
Format: Article
Language:English
Published: MDPI AG 2021-10-01
Series:Entropy
Subjects:
Online Access:https://www.mdpi.com/1099-4300/23/10/1366