Journal ArticleDOI
A molecular dynamics simulation of TiN film growth on TiN(0 0 1)
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TLDR
In this article, the growth of thin TiN films on the TiN(0,0,1) surface during reactive sputtering was simulated by molecular dynamics with the modified embedded-atom method potential.About:
This article is published in Computational Materials Science.The article was published on 2011-02-01. It has received 21 citations till now. The article focuses on the topics: Tin & Thin film.read more
Citations
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Fast parallel algorithms for short-range molecular dynamics
TL;DR: Comparing the results to the fastest reported vectorized Cray Y-MP and C90 algorithm shows that the current generation of parallel machines is competitive with conventional vector supercomputers even for small problems.
Journal ArticleDOI
Molecular dynamics simulation of VN thin films under indentation
TL;DR: In this paper, the authors investigated with molecular dynamics simulation the mechanical responses of VN thin films subjected to indentation with a diamond columnar indenter and found that the slip system is determined by the stacking-fault energy rather than the layer spacing.
Journal ArticleDOI
Molecular dynamics simulation of plasticity in VN(001) crystals under nanoindentation with a spherical indenter
Tao Fu,Xianghe Peng,Chen Wan,Zijun Lin,Xiaosheng Chen,Ning Hu,Zhongchang Wang,Zhongchang Wang +7 more
TL;DR: In this article, the authors performed molecular dynamics simulations of the nanoindentation on VN (001) films with a spherical indenter to elucidate the initial plastic deformation and the formation mechanisms of dislocation loops during nano-indentations.
Journal ArticleDOI
Molecular dynamics simulation of TiN (001) thin films under indentation
TL;DR: In this article, the second nearest-neighbor modified embedded atom method (2NN MEAM) potential was optimized for a Ti-N system based on single-element potential of Ti and N. The potential parameters were determined by fitting cohesive energy, lattice parameters, and elastic constants of TiN with a NaCl-type structure.
References
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Journal ArticleDOI
Fast parallel algorithms for short-range molecular dynamics
TL;DR: In this article, three parallel algorithms for classical molecular dynamics are presented, which can be implemented on any distributed-memory parallel machine which allows for message-passing of data between independently executing processors.
Fast parallel algorithms for short-range molecular dynamics
TL;DR: Comparing the results to the fastest reported vectorized Cray Y-MP and C90 algorithm shows that the current generation of parallel machines is competitive with conventional vector supercomputers even for small problems.
Book
The Stopping and Ranges of Ions in Matter
James F. Ziegler,J.P. Biersack +1 more
TL;DR: In this article, the authors reviewed the calculation of the stopping and the final range distribution of ions in matter, and showed the development of ion penetration theory by tracing how, as the theory developed through the years, various parts have been incorporated into tables and increased their accuracy.
Journal ArticleDOI
Universal features of the equation of state of metals
TL;DR: The zero-temperature equation of state of metals, in the absence of phase transitions, was shown to be accurately predicted from zero-pressure data in this article, and a simple universal relation was found.
Journal ArticleDOI
Thermal stability of nitride thin films
TL;DR: In this paper, a review of the thermal stability of state-of-the-art transition metal nitride thin films synthesized by physical vapour deposition techniques is presented, where the authors show that they are successfully applied as well.