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Grant: Discovery Grants Program - Individual

Carleton University

$64,000.00

Atomistic and Microstructural Computational Fatigue Design and Integrated Creep-Fatigue Theory for High-Temperature Alloys

FY 2023-24

Summary
Fatigue accounts for at least 90 percent of all service failures of components subjected to cyclic loading, as experienced by automobiles, aircraft, compressors, pumps, turbines, etc. Traditionally, engineers and researchers have to perform testing to determine a material's fatigue property, which results in high costs in time and money, thus prolonging the development cycle in material and component design for mechanical/structural systems. Recent research has reported that the low cycle fatigue (LCF) life of a material can be formulated in terms of material's physical properties including Burgers vector, shear modulus and surface energy. High cycle fatigue (HCF) is, in essence, a process of microstructural LCF crack nucleation plus crack propagation. Enlightened by these understandings, a computational fatigue design approach is proposed in the present research, aiming to search for new high-temperature alloys with superior fatigue resistance. A microstructure-based numerical model combined with first-principles density functional theory (DFT) will be developed and then used to predict the crack nucleation life of polycrystalline metals for a wide spectrum of loading from LCF to HCF. Furthermore, utilizing the deformation mechanisms involving glide and climb of dislocations within grain interior and along grain boundaries, a holistic theoretical framework - the integrated creep-fatigue theory (ICFT) for high-temperature alloys will also be proposed in the present research. The theoretical model established based on the first cornerstone leads to constitutive laws encompassing all possible deformation mechanisms and that based on the second cornerstone describes the damage accumulation process leading to fracture, and thus defines the life under general loading conditions that involve a combination of fatigue, creep and thermomechanical fatigue. Using this theory, only limited laboratory-testing will be required for a new material development such that material behavior under complicated loading conditions can be linked to the fundamental deformation mechanisms. Once established, the proposed theory and model will speed up material development and application to meet the fast-growing technological demands and stringent environmental requirements in the 21st century and future. They also have a great implication in prognosis and health management of existing or newly designed mechanical systems, with accurate life prediction, offering tremendous savings in life cycle management. In addition to the benefits for the research field, the proposed research has also planned the training of Highly Qualified Personnel (HQP) with serious consideration of Equity, Diversity and Inclusion (EDI). The time and cost saving using this research outcomes to design new materials and maintain mechanical systems to meet continuously increasing requirements for the gas turbine industry will certainly benefit and contribute to the economy and society of Canada.
Program
Discovery Grants Program - Individual
Location
Ontario, Canada
Recipient Type
Academia
Type
Grant
Source
NSERC's Awards Data

As published

Application id
RGPIN-2019-06264
Name nom
Liu, Rong
Department département
Mechanical & Aerospace Engineering - Mechanical & Aerospace Engineering
Organization id
23
Institution établissement
Carleton University
Province en
Ontario
Province fr
Ontario
Country en
CANADA
Country fr
CANADA
Fiscal year exercice financier
2023
Competition year année de concours
2019
Award amount
64000
Program id
RGPIN
Program name en
Discovery Grants Program - Individual
Program name fr
Programme de subventions à la découverte - individuelles
Group en
DISCOVERY RESEARCH
Group fr
RECHERCHE AXÉE SUR LA DÉCOUVERTE
Committee code
1512
Committee name en
Mechanical Engineering
Committee name fr
Génie mécanique
Area of application code
703
Area of application group en
Transportation systems and services
Area of application group fr
Services et systèmes de transport
Area of application en
Aerospace
Area of application fr
Aérospatial
Research subject code
2107
Research subject group en
Mechanical engineering
Research subject group fr
Modelling, simulation and finite element methods
Research subject en
Génie mécanique
Research subject fr
Modélisation, simulation et méthodes des éléments finis
Application title
Atomistic and Microstructural Computational Fatigue Design and Integrated Creep-Fatigue Theory for High-Temperature Alloys
Keyword
Additive manufacturing alloy; Atomistic and microstructural modeling; Computational design; Creep; Density functional theory; Fatigue; Grain boundary sliding; High-temperature alloy; Integrated creep-fatigue theory; Intragranular dislocation creep
Application summary
Fatigue accounts for at least 90 percent of all service failures of components subjected to cyclic loading, as experienced by automobiles, aircraft, compressors, pumps, turbines, etc. Traditionally, engineers and researchers have to perform testing to determine a material's fatigue property, which results in high costs in time and money, thus prolonging the development cycle in material and component design for mechanical/structural systems. Recent research has reported that the low cycle fatigue (LCF) life of a material can be formulated in terms of material's physical properties including Burgers vector, shear modulus and surface energy. High cycle fatigue (HCF) is, in essence, a process of microstructural LCF crack nucleation plus crack propagation. Enlightened by these understandings, a computational fatigue design approach is proposed in the present research, aiming to search for new high-temperature alloys with superior fatigue resistance. A microstructure-based numerical model combined with first-principles density functional theory (DFT) will be developed and then used to predict the crack nucleation life of polycrystalline metals for a wide spectrum of loading from LCF to HCF. Furthermore, utilizing the deformation mechanisms involving glide and climb of dislocations within grain interior and along grain boundaries, a holistic theoretical framework - the integrated creep-fatigue theory (ICFT) for high-temperature alloys will also be proposed in the present research. The theoretical model established based on the first cornerstone leads to constitutive laws encompassing all possible deformation mechanisms and that based on the second cornerstone describes the damage accumulation process leading to fracture, and thus defines the life under general loading conditions that involve a combination of fatigue, creep and thermomechanical fatigue. Using this theory, only limited laboratory-testing will be required for a new material development such that material behavior under complicated loading conditions can be linked to the fundamental deformation mechanisms. Once established, the proposed theory and model will speed up material development and application to meet the fast-growing technological demands and stringent environmental requirements in the 21st century and future. They also have a great implication in prognosis and health management of existing or newly designed mechanical systems, with accurate life prediction, offering tremendous savings in life cycle management. In addition to the benefits for the research field, the proposed research has also planned the training of Highly Qualified Personnel (HQP) with serious consideration of Equity, Diversity and Inclusion (EDI). The time and cost saving using this research outcomes to design new materials and maintain mechanical systems to meet continuously increasing requirements for the gas turbine industry will certainly benefit and contribute to the economy and society of Canada.