journal article·2020-11Open access

Thermal stability and mechanical properties of sputtered (Hf,Ta,V,W,Zr)-diborides

A. Kirnbauer, A. Wagner, V. Moraes, D. Primetzhofer, M. Hans, J.M. Schneider, P. Polcik, P.H. Mayrhofer

Acta Materialia· Volume 200

Abstract

Non-reactive magnetron sputtering of a diboride target composed of HfB2, TaB2, VB2, W2B5, and ZrB2 with equimolar composition leads to the formation of crystalline single-phase solid solution diboride thin films, (Hf,Ta,V,W,Zr)B2, with a high-entropy metal-sublattice. Their growth morphology (dense and fine-fibrous), crystal structure (AlB2-type), as well as mechanical properties (indentation modulus E of ~580 GPa and hardness H of ~45 GPa), and chemical compositions are basically independent of the substrate bias potential applied (varied between -40 and -100 V) during the deposition at 450°C. Detailed X-ray diffraction (XRD) and atom probe tomography (APT) studies indicate that the (Hf,Ta,V,W,Zr)B2 thin films remain single-phase AlB2-structured (with randomly distributed elements at the metal-sublattice) during vacuum-annealing at temperatures up to 1200°C. Only when increasing the annealing temperature to 1400°C, the formation of small orthorhombic structured (V,W)B-based regions can be detected, indicating the onset of decomposition of (Hf,Ta,V,W,Zr)B2 thin films into (Hf,Ta,Zr)B2 and (V,W)B, accompanied by the formation of confined B-rich boundary regions between these phases. After annealing at 1400°C the hardness is still very high with ~44 GPa, as the volume fraction of the newly formed (V,W)B-rich domains is small and the majority of the coating is still solid-solution (Hf,Ta,V,W,Zr)B2 with severe lattice distortions. Only at even higher Ta of 1500 and 1600 °C, H decreased to ~39 GPa.
Source: openalex_inverted_index · Quality: baseline

Research context

OpenAlex topics: Metal and Thin Film Mechanics · Diamond and Carbon-based Materials Research · Advanced Materials Characterization Techniques

SciVX discovery tags are terminology-based. OpenAlex topics are source-provided classifications.

References (45)

Show source-provided references
1. Microstructural development in equiatomic multicomponent alloys10.1016/j.msea.2003.10.257 ↗
2. Nanostructured High-Entropy Alloys With Multiple Principal Elements: Novel Alloy Design Concepts And Outcomes10.1002/adem.200300567 ↗
3. Murty · 2014
4. Mechanical properties and thermal stability of reactively sputtered multi-principal-metal Hf-Ta-Ti-V-Zr nitrides10.1016/j.surfcoat.2020.125674 ↗
5. A new class of high-entropy materials and a new type of ultrahigh temperature ceramics10.1038/srep37946 ↗
6. Dense high-entropy boride ceramics with ultra-high hardness10.1016/j.scriptamat.2019.01.021 ↗
7. Phase stability and distortion in high-entropy oxides10.1016/j.actamat.2017.12.037 ↗
8. High-entropy oxides: fundamental aspects and electrochemical properties
9. Rare earth and transition metal based entropy stabilised perovskite type oxides10.1016/j.jeurceramsoc.2017.12.058 ↗
10. Phase stability and mechanical properties of novel high entropy transition metal carbides10.1016/j.actamat.2018.12.054 ↗
11. High-entropy high-hardness metal carbides discovered by entropy descriptors10.1038/s41467-018-07160-7 ↗
12. Lai · Influence of substrate temperature on structure and mechanical, properties of multi-element (AlCrTaTiZr) N coatings · 2007 · 201 · 6993
13. Effect of substrate bias on the structure and properties of multi-element (AlCrTaTiZr)N coatings10.1088/0022-3727/39/21/019 ↗
14. Preparation and characterization of AlCrTaTiZr multi-element nitride coatings10.1016/j.surfcoat.2006.06.048 ↗
15. Multiprincipal-element AlCrTaTiZr-nitride nanocomposite film of extremely high thermal stability as diffusion barrier for Cu metallization
16. High-entropy oxide thin films based on Al–Cr–Nb–Ta–Ti10.1016/j.vacuum.2019.108850 ↗
17. High-entropy ceramic thin films; A case study on transition metal diborides10.1016/j.scriptamat.2018.02.008 ↗
18. Substoichiometry and tantalum dependent thermal stability of α-structured W-Ta-B thin films10.1016/j.scriptamat.2018.06.005 ↗
19. Thermally stable superhard diborides: an ab initio guided case study for V-W-diboride thin films10.1016/j.actamat.2020.01.014 ↗
20. Influence of Tantalum on phase stability and mechanical properties of WB210.1557/mrc.2019.5 ↗
21. P. Villars, H. Okamoto, eds., B-Hf Binary Phase Diagram 0-100 at% Hf: Datasheet from ``PAULING FILE Multinaries Edition – 2012’’ in SpringerMaterials (https://materials.springer.com/isp/phase-diagram/docs/c_0905924),
22. P. Villars, H. Okamoto, eds., B-Ta Binary Phase Diagram 0-100 at% Ta: Datasheet from ``PAULING FILE Multinaries Edition – 2012’’ in SpringerMaterials (https://materials.springer.com/isp/phase-diagram/docs/c_0902231),
23. P. Villars, H. Okamoto, eds., B-V Binary Phase Diagram 0-100 at% V: Datasheet from ``PAULING FILE Multinaries Edition – 2012’’ in SpringerMaterials (https://materials.springer.com/isp/phase-diagram/docs/c_0903210),
24. P. Villars, H. Okamoto, eds., B-W Binary Phase Diagram 0-100 at% W: Datasheet from ``PAULING FILE Multinaries Edition – 2012’’ in SpringerMaterials (https://materials.springer.com/isp/phase-diagram/docs/c_0103126),
25. P. Villars, H. Okamoto, eds., B-Zr Binary Phase Diagram 0-100 at% Zr: Datasheet from ``PAULING FILE Multinaries Edition – 2012’’ in SpringerMaterials (https://materials.springer.com/isp/phase-diagram/docs/c_0907059),
26. A combined segmented anode gas ionization chamber and time-of-flight detector for heavy ion elastic recoil detection analysis
27. Ion beam analysis of fusion plasma-facing materials and components: facilities and research challenges10.1088/1741-4326/ab5817 ↗
28. An improved technique for determining hardness and elastic modulus using load and displacement sensing indentation experiments10.1557/JMR.1992.1564 ↗
29. In situ site-specific specimen preparation for atom probe tomography10.1016/j.ultramic.2006.06.008 ↗
30. From ultrasoft pseudopotentials to the projector augmented-wave method10.1103/PhysRevB.59.1758 ↗
31. Generalized gradient approximation made simple10.1103/PhysRevLett.77.3865 ↗
32. The alloy theoretic automated toolkit: A user guide10.1016/S0364-5916(02)80006-2 ↗
33. Calculations of single-crystal elastic constants made simple10.1016/j.cpc.2009.11.017 ↗
34. Titrian, U. Aydin, M. Friák, D. Ma, D. Raabe, J. Neugebauer, Self-consistent scale-bridging approach to compute the elasticity of multi-phase polycrystalline materials, 2012. doi:10.1557/opl.201.41.10.1557/opl.2013.41 ↗
35. Theory-guided materials design of multi-phase Ti-Nb alloys with bone-matching elastic properties10.3390/ma5101853 ↗
36. Ab initio study of single-crystalline and polycrystalline elastic properties of Mg-substituted calcite crystals10.1016/j.jmbbm.2013.01.030 ↗
37. On transformation strains and uniform fields in multiphase elastic media
38. Böhm · 2005
39. Thermally induced self-hardening of nanocrystalline Ti-B-N thin films
40. A structure zone diagram including plasma-based deposition and ion etching10.1016/j.tsf.2009.10.145 ↗
41. Spinodal decomposition of cubic Ti1-xAlxN: comparison between experiments and modeling
42. Decomposition pathways in age hardening of Ti-Al-N films
43. Atom probe tomography field evaporation characteristics and compositional corrections of ZrB210.1016/j.matchar.2019.109871 ↗
44. Binäre und ternäre Carbid‐ und Nitridsysteme der Übergangsmetalle
45. Material selection for hard coatings10.1116/1.573700 ↗