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Si/Ge (111) Semicoherent Interfaces: Responses to an In‐Plane Shear and Interactions with Lattice Dislocations

Journal Article · · Physica Status Solidi B. Basic Solid State Physics
 [1];  [2];  [2]
  1. California NanoSystems Institute University of California, Santa Barbara Santa Barbara CA 93106-6105 USA
  2. Department of Mechanical and Aerospace Engineering University of Florida Gainesville FL 32611 USA

Concurrent atomistic–continuum simulations are employed to study Si/Ge (111) semicoherent interfaces in terms of their responses to an in‐plane shear and interactions with lattice dislocations. Three types of Si/Ge interfaces, differing in interfacial structures and energy, are considered. Type I interface coincides with the shuffle‐set slip plane and contains a hexagonal network of edge dislocations. Type II and Type III interfaces both coincide with the glide‐set slip plane, yet they contain, respectively, a triangular and a hexagonal network of Shockley partial dislocations. The simulations show that among the three types of interfaces, 1) Type I interface is the least stable subject to an in‐plane shear and 2) Type III interface impedes the gliding of lattice dislocations the most significantly.

Sponsoring Organization:
USDOE
Grant/Contract Number:
NONE; SC0006539
OSTI ID:
1786495
Alternate ID(s):
OSTI ID: 1850946
Journal Information:
Physica Status Solidi B. Basic Solid State Physics, Journal Name: Physica Status Solidi B. Basic Solid State Physics Journal Issue: 12 Vol. 257; ISSN 0370-1972
Publisher:
Wiley Blackwell (John Wiley & Sons)Copyright Statement
Country of Publication:
Germany
Language:
English

References (52)

Atomistic Modeling of Misfit Dislocations for Ge/(001)Si and Ge/(111)Si journal January 1999
Atomistic Modeling of Misfit Dislocation Network Variants for Ge/Si(111) Interfaces journal November 2000
Lattice mismatch accommodation atGeSi/{111}Si interfaces grown by liquid phase epitaxy journal June 1992
Comparing EAM Potentials to Model Slip Transfer of Sequential Mixed Character Dislocations Across Two Symmetric Tilt Grain Boundaries in Ni journal March 2017
Martensite journal January 1953
Bi surfactant mediated epitaxy of Ge on Si(111) journal April 1999
Shear stress- and line length-dependent screw dislocation cross-slip in FCC Ni journal January 2017
Interfacial-dislocation-controlled deformation and fracture in nanolayered composites: Toward higher ductility of drawn pearlite journal February 2019
Sequential obstacle interactions with dislocations in a planar array journal August 2019
Atomistic modeling of the interaction between matrix dislocation and interfacial misfit dislocation networks in Ni-based single crystal superalloy journal April 2013
Dislocation migration across coherent phase interfaces in SiGe superlattices journal January 2016
The effect of the misfit dislocation on the in-plane shear response of the ferrite/cementite interface journal February 2020
Mesh refinement schemes for the concurrent atomistic-continuum method journal July 2016
An analysis of key characteristics of the Frank-Read source process in FCC metals journal November 2016
Dislocation-mediated plasticity in silicon during nanometric cutting: A molecular dynamics simulation study journal August 2016
Dislocation nucleation from symmetric tilt grain boundaries in body-centered cubic vanadium journal May 2018
Nucleation and growth of dislocation loops in Cu, Al and Si by a concurrent atomistic-continuum method journal October 2012
Comparison between surfactant-mediated Bi/Ge/Si(111) epitaxy and Ge/Si(111) epitaxy journal August 2004
Dislocation networks in conventional and surfactant-mediated Ge/Si(111) epitaxy journal December 2005
Challenges in epitaxial growth of SiGe buffers on Si (111), (110), and (112) journal June 2006
Misfit dislocation network in Cu/Ni multilayers and its behaviors during scratching journal February 2007
Perfect Strain Relaxation in Metamorphic Epitaxial Aluminum on Silicon through Primary and Secondary Interface Misfit Dislocation Arrays journal June 2018
Dislocation nucleation facilitated by atomic segregation journal November 2017
Sequential slip transfer of mixed-character dislocations across Σ3 coherent twin boundary in FCC metals: a concurrent atomistic-continuum study journal January 2016
Pure-edge dislocation network for strain-relaxed SiGe∕Si(001) systems journal May 2005
Reformulation of microscopic balance equations for multiscale materials modeling journal April 2009
Two‐dimensional growth of strained Ge 0.85 Si 0.15 on Si(111) by liquid phase epitaxy journal September 1992
Shuffle-glide dislocation transformation in Si journal February 2013
A molecular dynamics study of tilt grain boundary resistance to slip and heat transfer in nanocrystalline silicon journal December 2014
Concurrent atomistic-continuum modeling of crystalline materials journal September 2019
Atomistic study of dislocation nucleation in Ge/(001)Si heterostructuses journal August 1995
Concurrent atomistic-continuum simulations of uniaxial compression of gold nano/submicropillars journal May 2018
Atomistic formulation of a multiscale field theory for nano/micro solids journal November 2005
Dislocation transmission across the Cu/Ni interface: a hybrid atomistic–continuum study journal February 2007
Concurrent atomistic–continuum simulation of polycrystalline strontium titanate journal August 2015
Visualization and analysis of atomistic simulation data with OVITO–the Open Visualization Tool journal December 2009
Automated identification and indexing of dislocations in crystal interfaces journal October 2012
Computer simulation of local order in condensed phases of silicon journal April 1985
Molecular-dynamics simulation of amorphous germanium journal November 1986
Surfactant-mediated growth of Ge on Si(111) journal October 1994
Structural properties of Si 1 − x Ge x alloys: A Monte Carlo simulation with the Stillinger-Weber potential journal February 1995
Local momentum and heat fluxes in transient transport processes and inhomogeneous systems journal November 2016
Physical foundation and consistent formulation of atomic-level fluxes in transport processes journal November 2018
The search for novel, superhard materials journal September 1999
The origin of the distinction between microscopic formulas for stress and Cauchy stress journal November 2016
The Critical Stress for Transmission of a Dislocation Across an Interface: Results From Peierls and Embedded Atom Models journal January 1999
Characterizing interface dislocations by atomically informed Frank-Bilby theory journal April 2013
PyCAC: The concurrent atomistic-continuum simulation environment journal January 2018
A multiscale study of misfit dislocations in PbTe/PbSe(001) heteroepitaxy journal April 2019
Metamorphic epitaxial materials journal March 2016
Modeling Plastic Deformation of Nano/Submicron-Sized Tungsten Pillars Under Compression: a Coarse-Grained Atomistic Approach journal January 2018
Validation of the Concurrent Atomistic-Continuum Method on Screw Dislocation/Stacking Fault Interactions journal April 2017

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