19 citations · 51 across the 11 of their papers we have counts for
4 papers · 1 filter
Interfacial Behavior from the Atomic Blueprint: Machine Learning-Guided Design of Spatially Functionalized a-SiO2 Surfaces
Evgenii Strugovshchikov, Viktor Mandrolko, Dominika Lesnicki +3
a-Quartz surfaces functionalized with hydroxyl and methyl groups provide a versatile platform for controlling interfacial properties critical to applications such as catalysis, pro…
Decorated dislocations against phonon propagation for thermal management
Stefanos Giaremis, Joseph Kioseoglou, Mykola Isaiev +3
The impact of decorated dislocations on the effective thermal conductivity of GaN is investigated by means of equilibrium molecular dynamics simulations via the Green-Kubo approach…
Features of photothermal transformation in porous silicon based multilayered structures
K. Dubyk, L. Chepela, P. Lishchuk +3
This paper is devoted to the study of photothermal transformations in multilayered structures. As a modelled sample, porous silicon with a periodic distribution of the porosity was…
Thermal conductivity of strained silicon: molecular dynamics insight and kinetic theory approach
Vasyl Kuryliuk, Oleksii Nepochatyi, Patrice Chantrenne +2
In this work, we investigated tensile and compression forces effect on the thermal conductivity of silicon. We used equilibrium molecular dynamics approach for the evaluation of th…