Cross-scale analysis of nickel Superalloy fatigue using Markov state model-molecular dynamics method

Molecular dynamics (MD) simulation is an advanced method in microscale modelling of material but it depends on the complexity of the model. The performance of MD simulation is poor once the model size is huge. To accelerate the computing of MD simulation, the Markov state model (MSM) can be applied...

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Bibliographic Details
Main Authors: Jianfeng Huang, Don McGlinchey, Yi Chen, Daniel McMahon
Format: Article
Language:English
Published: Elsevier 2021-01-01
Series:Materials & Design
Subjects:
Online Access:http://www.sciencedirect.com/science/article/pii/S0264127520307619