Literature DB >> 19257207

Friedel oscillations are limiting the strength of superhard nanocomposites and heterostructures.

R F Zhang1, A S Argon, S Veprek.   

Abstract

To obtain a deeper understanding of the mechanism of plastic deformation and failure in superhard nanocomposites and heterostructures we studied, by means of the ab initio density functional theory, the stress-strain response and the change of the electronic structure during tensile and shear deformation of a prototype interfacial systems consisting of 1 monolayer SiN sandwiched between a few nm thick TiN layers. This shows that peak Friedel oscillations of valence charge density weaken the Ti-N interplanar bonds next to that interface, where decohesion in tension and slip in shear occurs. These results provide ways to design new, stronger and harder materials.

Entities:  

Year:  2009        PMID: 19257207     DOI: 10.1103/PhysRevLett.102.015503

Source DB:  PubMed          Journal:  Phys Rev Lett        ISSN: 0031-9007            Impact factor:   9.161


  3 in total

1.  The peculiarity of the metal-ceramic interface.

Authors:  Zaoli Zhang; Yao Long; S Cazottes; R Daniel; C Mitterer; G Dehm
Journal:  Sci Rep       Date:  2015-06-19       Impact factor: 4.379

2.  First-principles quantum molecular dynamics study of Ti x Zr1-x N(111)/SiN y heterostructures and comparison with experimental results.

Authors:  Volodymyr Ivashchenko; Stan Veprek; Alexander Pogrebnjak; Bogdan Postolnyi
Journal:  Sci Technol Adv Mater       Date:  2014-04-30       Impact factor: 8.090

3.  Electron work function - a probe for interfacial diagnosis.

Authors:  D Y Li; Liqiu Guo; Lei Li; Hao Lu
Journal:  Sci Rep       Date:  2017-08-29       Impact factor: 4.379

  3 in total

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