Effects of pressure on the generalized stacking fault energy and twinning propensity of face-centered cubic metals
Creators
- 1. School of Materials Science and Engineering, University of Science and Technology of China, Shenyang 110016 (China)
- 2. Shi-changxu Innovation Center for Advanced Materials, Institute of Metal Research, Chinese Academy of Sciences, Shenyang 110016 (China)
- 3. School of Information Science and Engineering, Shenyang University of Technology, Shenyang 111003 (China)
- 4. School of Materials Science and Engineering, Northeastern University, Shenyang 110819 (China)
Description
Highlights: • Pressure effects on the twinning propensity of FCC metals with medium/low SFE were studied. • The core structures of dislocation were explored in Cu and Ag at pressures. • Strong pressure dependence of twinning propensity was found in Ag and CoCrFeMnNi high entropy alloys. • The alternation of twinning propensity with pressure relies on the change of phase stability. -- Abstract: The effects of pressure on the generalized stacking fault energies (GSFE), core structure of dissociated dislocation, twinning propensity and phase stability are comprehensively investigated by molecular statics simulations and first principles calculations in three typical face-centered cubic (FCC) metals, Cu, Ag and the equiatomic CoCrFeMnNi high-entropy alloy (HEA). It demonstrates that the pressure has an important impact on the morphology of GSFEs in Cu, Ag and the CoCrFeMnNi HEA. In contrast to the slight improvement of twinning propensity in Cu, a substantial enhancement of twinning propensity is caused by high pressures in Ag and the CoCrFeMnNi HEA. The first principles calculation indicates that the dependence of stacking fault energy and the relative stability of FCC and HCP phases on the pressure dictates the sensitivity of twinning propensity to the pressure in FCC metals. The results not only shed new light on the pressure effects on the twinning propensity, but also have an important implication on the manipulation of deformation mechanisms and mechanical properties in FCC metals.
Additional details
Identifiers
- DOI
- 10.1016/j.jallcom.2021.158869;
- PII
- S0925838821002760;
Publishing Information
- Journal Title
- Journal of Alloys and Compounds
- Journal Volume
- 866
- Journal Page Range
- vp.
- ISSN
- 0925-8388
- CODEN
- JALCEU
INIS
- Country of Publication
- Switzerland
- Country of Input or Organization
- International Atomic Energy Agency (IAEA)
- INIS RN
- 55034241
- Subject category
- S36: MATERIALS SCIENCE; S75: CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND SUPERFLUIDITY;
- Descriptors DEI
- ALLOYS; COPPER; FCC LATTICES; HCP LATTICES; MECHANICAL PROPERTIES; MOLECULAR DYNAMICS METHOD; PHASE STABILITY; PHASE TRANSFORMATIONS; PRESSURE DEPENDENCE; SILVER; STACKING FAULTS; TWINNING
- Descriptors DEC
- CALCULATION METHODS; CRYSTAL DEFECTS; CRYSTAL LATTICES; CRYSTAL STRUCTURE; CUBIC LATTICES; ELEMENTS; HEXAGONAL LATTICES; METALS; STABILITY; THREE-DIMENSIONAL LATTICES; TRANSITION ELEMENTS
Optional Information
- Copyright
- Copyright (c) 2021 Elsevier B.V. All rights reserved.