标题: 求助如何分析能带，态密度，声子谱 [打印本页] 作者Author: tedious 时间: 2024-3-13 13:08 标题: 求助如何分析能带，态密度，声子谱 求助如何分析能带，态密度，声子谱，或者有什么视频和书可以参考吗？作者Author: sobereva 时间: 2024-3-13 14:39
能带、态密度
Solids and Surfaces-A Chemist's View of Bonding in Extended Structures (1988,Roald Hoffmann)
Computational Chemistry of Solid State Materials (Richard Dronskowski,2005)
Density functional theory-A Practical Introduction (Sholl,2009)
Electronic Structure-Basic Theory and Practical Methods (2ed,Martin,2020)
Materials Modelling using Density Functional Theory-Properties and Predictions (Giustino,2014)
Methods of Electronic-Structure Calculations-From Molecules to Solids (Springborg,2000)
Molecular modelling Principles and applications (2ed,Leach,2001)
Quantum Chemistry of Solids-The LCAO First Principles Treatment of Crystals (Evarestov,2007)
声子谱：Journal of the Physical Society of Japan 92, 012001 (2023)。以及同作者其它文章