Ab initio lattice dynamics for materials design and characterisation

被引：0
|
作者：
Skelton, Jonathan Michael [1 ]
Raithby, Paul [1 ]
Walsh, Aron [2 ]
Parker, Stephen [1 ]
机构：
[1] Univ Bath, Dept Chem, Bath, Avon, England
[2] Imperial Coll London, Dept Mat, London, England
来源：
ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES | 2017年 / 73卷
关键词：
first-principles materials modelling; lattice dynamics; phonons;
D O I：
10.1107/S2053273317094943
中图分类号：
O6 [化学];
学科分类号：
0703 ;
摘要：
MS006.O04
引用
收藏
页码：C77 / C77
页数：1
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