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Comparison of Methods for Characterization of Magnetocaloric Materials
I compare three different computational methods for calculating the magnetocaloric effect (MCE) in Fe, Gd, MnBi, and FeRh, using the software package UppASD.The studied Monte Carlo (MC) simulation has a classical approach ...
Optical Simulations of Face Mask Materials using Forward Ray Tracing
In this thesis, I will study the feasibility of using UV light to decontaminate face masks. The process has been experimentally proven to be possible by Titta Kiiskinen. In her thesis, Kiiskinen explains that the mechanism ...
Gradient Observations in Global Structure Search with Bayesian Optimization
Knowledge of the microscopic atomic structure of a material gives insight into its macroscopic properties, which facilitates tailoring of the material for specific functionalities. Potential obstacles encountered during ...