Research on Mechanical Properties of High-Pressure Anhydrite Based on First Principles

This article focuses on the elucidation of a three-dimensional model of the structure of anhydrite crystal (CaSO<sub>4</sub>). The structure parameters of anhydrite crystal were obtained by means of first principles after structure optimization at 0~120 MPa. In comparison with previous e...

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Bibliographic Details
Main Authors: Xianren Zeng, Shihui You, Linmei Li, Zhangli Lai, Guangyan Hu, Wenjuan Zhang, Yuan Xie
Format: Article
Language:English
Published: MDPI AG 2020-03-01
Series:Crystals
Subjects:
Online Access:https://www.mdpi.com/2073-4352/10/4/240