Vibrational Enthalpies of Solid Crystalline Materials

Specific heat at constant pressure is traditionally a difficult thermodynamic quantity to obtain from first-principles calculations. While theoretical avenues to <inline-formula><math xmlns="http://www.w3.org/1998/Math/MathML" display="inline"><semantics><mro...

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Bibliographic Details
Main Author: Christopher Martin Stanley
Format: Article
Language:English
Published: MDPI AG 2022-05-01
Series:Solids
Subjects:
Online Access:https://www.mdpi.com/2673-6497/3/2/23