范德瓦尔斯力
石墨烯
材料科学
电介质
单原子气体
凝聚态物理
卡西米尔效应
密度泛函理论
随机相位近似
带隙
哈梅克常数
单层
化学物理
范德瓦尔斯半径
纳米技术
物理
量子力学
光电子学
分子
作者
Xiaofei Liu,Zhuhua Zhang,Wanlin Guo
出处
期刊:Physical review
[American Physical Society]
日期:2018-06-28
卷期号:97 (24)
被引量:18
标识
DOI:10.1103/physrevb.97.241411
摘要
The ubiquitous van der Waals (vdW) interaction determines the fundamental properties of material surfaces. Here, we show that graphene can partly screen the vdW energy by up to 53%, as tested in a graphene trilayer and a sandwiched BN/graphene/BN multilayer using the random phase approximation and density functional theory based many-body-dispersion method. The vdW screening turns weaker in semiconducting and insulating graphenelike monoatomic layers, displaying a strong correlation with the band gap and the dielectric constant of materials, but depends less on the screened materials. The revealed relationship between the vdW screening and the fundamental electronic structure of the graphenelike material will be instrumental in the rational control of surface interactions.
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