Mechanical failure of metal/ceramic interfacial regions under shear loading
Source abstract
Abstract
Abstract Shear failure of the interfacial regions of CrN/Cu/Si and CrN/Ti/Si ceramic-coating/metal-adhesion-layer/substrate systems was measured quantitatively and observed concurrently through instrumented compression of cylindrical micro-pillars in-situ a scanning electron microscope. Results indicate that shear failure of the interfacial region occurred in two stages: an initial shear deformation of the entire metal interlayer followed by an unstable shear-off close to the metal/ceramic interface. The shear-off is suggested to be concomitant with the metal/ceramic interface going from being “locked”, with no relative displacement between materials on the two sides of the interface, to being “unlocked”, with significant relative displacements. Density functional theory and molecular dynamics studies on a related metal/ceramic interface, Ti/TiN, showed that a weak interaction plane exists in the metal layer near the chemical interface in a coherent Ti/TiN structure. Consequently, the free energy and theoretical shear strength of the semi-coherent Ti/TiN interface is found to depend on the physical location of the misfit dislocation network (MDN). The minimum energy and strength of the interface occur when the MDN is near, but not at the chemical interface. The relevance of the present work to other metal/ceramic interfaces is discussed.
Source: openaire · Quality: candidate unverified · Source record ↗
Research context
OpenAlex topics: Metal and Thin Film Mechanics · Advanced ceramic materials synthesis · Microstructure and mechanical properties
SciVX discovery tags are terminology-based. OpenAlex topics are source-provided classifications.
References (48)
Show source-provided references
1. Holmberg · 2009
2. Adherence failure and measurement: some troubling questions10.1163/156856194X00438 ↗
3. On the evaluation of adhesion of coatings by automatic scratch testing10.1163/156856193X00439 ↗
4. Measurement of the adhesion of a brittle film on a ductile substrate by indentation10.1098/rspa.1996.0124 ↗
5. A simple technique for measuring the adhesion of brittle films to ductile substrates with application to diamond-coated titanium10.1557/JMR.1997.0260 ↗
6. Measurement of the ultimate shear strength of a metal-ceramic interface10.1016/0001-6160(89)90120-X ↗
7. Metal-ceramic adhesion and the harris functional10.1103/PhysRevLett.72.4021 ↗
8. Ab initio molecular dynamics for liquid metals10.1103/PhysRevB.47.558 ↗
9. Ab initio molecular-dynamics simulation of the liquid-metal–amorphous-semiconductor transition in germanium10.1103/PhysRevB.49.14251 ↗
10. Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set10.1016/0927-0256(96)00008-0 ↗
11. Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set10.1103/PhysRevB.54.11169 ↗
12. QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials10.1088/0953-8984/21/39/395502 ↗
13. Nobel Lecture: electronic structure of matter—wave functions and density functionals10.1103/RevModPhys.71.1253 ↗
14. Allen · 1987
15. Embedded-atom method: derivation and application to impurities, surfaces, and other defects in metals10.1103/PhysRevB.29.6443 ↗
16. Modified embedded-atom potentials for cubic materials and impurities10.1103/PhysRevB.46.2727 ↗
17. Fast parallel algorithms for short-range molecular dynamics10.1006/jcph.1995.1039 ↗
18. Temperature dependence of inductively coupled plasma assisted growth of TiN thin films10.1016/S0257-8972(99)00457-0 ↗
19. Measuring critical stress for shear failure of interfacial regions in coating/interlayer/substrate systems through a micro-pillar testing protocol10.1557/jmr.2016.516 ↗
20. A new experimental approach for evaluating the mechanical integrity of interfaces between hard coatings and substrates10.1557/mrc.2014.3 ↗
21. Generalized gradient approximation made simple10.1103/PhysRevLett.77.3865 ↗
22. Ab-initio simulations of materials using VASP: density-functional theory and beyond10.1002/jcc.21057 ↗
23. Projector augmented-wave method10.1103/PhysRevB.50.17953 ↗
24. From ultrasoft pseudopotentials to the projector augmented-wave method10.1103/PhysRevB.59.1758 ↗
25. Lee · 2011
26. Theory of metal—ceramic adhesion10.1016/0956-7151(94)00457-S ↗
27. Deformation mechanisms in Ti/TiN multilayer under compressive loading10.1016/j.actamat.2016.09.039 ↗
28. Interface effect on tribological properties of titanium–titanium nitride nanolaminated structures10.1016/S0257-8972(00)00663-0 ↗
29. Modified embedded-atom method interatomic potentials for the Ti–C and Ti–N binary systems10.1016/j.actamat.2008.03.027 ↗
30. Toth · 1971
31. Modeling interface-dominated mechanical behavior of nanolayered crystalline composites10.1007/s11837-013-0808-8 ↗
32. Spiral patterns of dislocations at nodes in (111) semi-coherent FCC interfaces10.1038/srep02448 ↗
33. Misfit dislocation patterns of Mg-Nb interfaces10.1016/j.actamat.2016.12.041 ↗
34. Role of interface structure on the plastic response of Cu/Nb nanolaminates under shock compression: non-equilibrium molecular dynamics simulations10.1016/j.scriptamat.2012.09.022 ↗
35. Atomistic simulations of the shear strength and sliding mechanisms of copper–niobium interfaces10.1016/j.actamat.2008.03.003 ↗
36. Glide dislocation nucleation from dislocation nodes at semi-coherent {111} Cu–Ni interfaces10.1016/j.actamat.2015.07.044 ↗
37. Hirth · 1982
38. Mechanical properties of thin films10.1007/BF02666659 ↗
39. Dependence of confined plastic flow of polycrystalline Cu thin films on microstructure10.1557/mrc.2016.20 ↗
40. Intrinsic stresses and mechanical properties of Ti-containing hydrocarbon coatings10.1063/1.1578523 ↗
41. Micro-pillar measurements of plasticity in confined Cu thin films10.1016/j.eml.2014.12.001 ↗
42. Density functional theory investigations of titanium γ -surfaces and stacking faults10.1088/0965-0393/21/1/015009 ↗
43. The size of a dislocation10.1088/0959-5309/52/1/305 ↗
44. Dislocations in a simple cubic lattice10.1088/0959-5309/59/2/309 ↗
45. Energy minimization mechanisms of semi-coherent interfaces10.1063/1.4889927 ↗
46. Structural modifications due to interface chemistry at metal-nitride interfaces10.1038/srep17380 ↗
47. Relaxation, structure, and properties of semicoherent interfaces10.1007/s11837-015-1691-2 ↗
48. The deformation physics of nanocrystalline metals: experiments, analysis, and computations10.1007/s11837-006-0214-6 ↗