Superstrength through Nanotwinning

被引：69

作者：

An, Qi ^{[1
]}

Goddard, William A., III ^{[1
]}

Xie, Kelvin Y. ^{[2
]}

Sim, Gi-dong ^{[2
]}

Hemker, Kevin J. ^{[2
]}

Munhollon, Tyler ^{[3
]}

Toksoy, M. Fatih ^{[3
]}

Haber, Richard A. ^{[3
]}

机构：

[1] CALTECH, Mat & Proc Simulat Ctr, Pasadena, CA 91125 USA

[2] Johns Hopkins Univ, Dept Mech Engn, Baltimore, MD 21218 USA

[3] Rutgers State Univ, Dept Mat Sci & Engn, Piscataway, NJ 08854 USA

来源：

NANO LETTERS | 2016年 / 16卷 / 12期

基金：

美国国家科学基金会;

关键词：

Superhard ceramics; hardness; DFT; nanoindentation; deformation mechanism; PRESSED BORON-CARBIDE; STRENGTH; ALUMINUM; HARDNESS; MAXIMUM;

D O I：

10.1021/acs.nanolett.6b03414

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

The theoretical strength of a material is the minimum stress to deform or fracture the perfect single crystal material that has no defects. This theoretical strength is considered as an upper bound on the attainable strength for a real crystal. In contradiction to this expectation, we use quantum mechanics (QM) simulations to show that for the boron carbide (B4C) hard ceramic, this theoretical shear strength can be exceeded by 11% by imposing nanoscale twins. We also predict from QM that the indentation strength of nanotwinned B4C is 12% higher than that of the perfect crystal. Further, we validate this effect experimentally, showing that nanotwinned samples are harder by 2.3% than the twin-free counterpart of B4C. The origin of this strengthening mechanism is suppression of twin boundary (TB) slip within the nanotwins due to the directional nature of covalent bonds at the TB.

引用

页码：7573 / 7579

页数：7

共 39 条

[1] Atomistic Origin of Brittle Failure of Boron Carbide from Large-Scale Reactive Dynamics Simulations: Suggestions toward Improved Ductility [J].