Octalithium tin (IV) oxide (LiSnO) is an important electrode material considered for lithium ion batteries (LIBs) because of its high lithium content. We employed atomistic simulations to examine the intrinsic defects, diffusion of Li-ions together with their migration energies and solution of potential dopants in LiSnO. The most thermodynamically favourable intrinsic defect is the Li Frenkel which increases the concentration of Li vacancies needed for the vacancy mediated diffusion of Li-ions in LiSnO.
View Article and Find Full Text PDFLocal modification of magnetic properties of nanoelements is a key to design future-generation magnonic devices in which information is carried and processed via spin waves. One of the biggest challenges here is to fabricate simple and miniature phase-controlling elements with broad tunability. Here, we successfully realize such spin-wave phase shifters upon a single nanogroove milled by a focused ion beam in a Co-Fe microsized magnonic waveguide.
View Article and Find Full Text PDFMagnesium titanate is technologically important due to its excellent dielectric properties required in wireless communication system. Using atomistic simulation based on the classical pair potentials we study the defect chemistry, Mg and O diffusion and a variety of dopant incorporation at Mg and Ti sites. The defect calculations suggest that cation anti-site defect is the most favourable defect process.
View Article and Find Full Text PDFCarbon constitutes a significant defect in silicon (Si) as it can interact with intrinsic point defects and affect the operation of devices. In heavily irradiated Si containing carbon the initially produced carbon interstitial-carbon substitutional (CC) defect can associate with self-interstitials (Si's) to form, in the course of irradiation, the CC(Si) defect and further form larger complexes namely, CC(Si) defects, by the sequential trapping of self-interstitials defects. In the present study, we use density functional theory to clarify the structure and energetics of the CC(Si) defects.
View Article and Find Full Text PDFThe interaction of (quasi)particles with a periodic potential arises in various domains of science and engineering, such as solid-state physics, chemical physics, and communication theory. An attractive test ground to investigate this interaction is represented by superconductors with artificial pinning sites, where magnetic flux quanta (Abrikosov vortices) interact with the pinning potential U(r) = U(r + R) induced by a nanostructure. At a combination of microwave and dc currents, fluxons act as mobile probes of U(r): The ac component shakes the fluxons in the vicinity of their equilibrium points which are unequivocally determined by the local pinning force counterbalanced by the Lorentz force induced by the dc current, linked to the curvature of U(r) which can then be used for a successful fitting of the voltage responses.
View Article and Find Full Text PDFWe have created two sheets of approximately 1 K phonons in liquid (4)He at approximately 55 mK such that they intersect each other as they move towards a common point. If the two sheets have a small angle between them, they interact strongly and create a hot line in the liquid helium. This line is continuously fed with energy from the two sheets and loses energy by creating high-energy phonons.
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