First-Principles Structural, Mechanical, and Thermodynamic Calculations of the Negative Thermal Expansion Compound Zr2(WO4)(PO4)2

Bibliographic Details
Main Authors: Philippe F. Weck, Eunja Kim, Margaret E. Gordon, Jeffery A. Greathouse, Rémi Dingreville, Charles R. Bryan
Format: Article
Language:English
Published: American Chemical Society 2018-11-01
Series:ACS Omega
Online Access:http://dx.doi.org/10.1021/acsomega.8b02456