Understanding Nucleation Sites in MatCalc Simulations
Nucleation sites of precipitates in MatCalc simulations are crucial for understanding the nucleation rate, available sites, interfacial energy models, and more. This analysis delves into the consequences and special cases of nucleation, including factors such as dislocation density, grain boundaries
0 views • 32 slides
Understanding MatCalc Approach for Modelling Precipitate/Matrix Interfacial Energy
MatCalc app provides a detailed examination of the precipitate/matrix interfacial energy modeling by considering various contributions to Gibbs energy, classical nucleation theory, coarsening (Ostwald ripening), and estimation methods like the Becker concept. The interface energy is crucial for unde
1 views • 33 slides
Trapping Modelling in MatCalc: Understanding Gibbs Energy and Configurational Entropy
Trapping modelling in MatCalc involves studying the entrapment of atoms on lattice defects like solute atoms and dislocations. This process affects the system's energy and concentration, with parameters such as trapping enthalpy, nominal composition, and molar volume playing vital roles. By consider
0 views • 21 slides