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Alexandra Siklitskaya

Publications and source records attributed to Alexandra Siklitskaya.

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Localization--non-ergodic transition in controllable-dimension fractal networks from diffusion-limited aggregation

Our study connects the physics of disordered integer-dimensional systems and regular self-similar objects by studying spectral properties of fractal agglomerates with tunable dimension. The latter is controlled by parameter $α$ of the algorithm that generates the agglomerates. We consider the nearest-neighbor tight-binding model on the agglomerates embedded in 2D and 3D, and observe that all eigenstates are localized in the 2D case, whereas in the 3D case, there is a localization--non-ergodic transition upon increasing $α$,i.e., going from sparse to dense fractals: a sub-extensive number of critical states emerge in the spectrum at a certain critical value of $α$. The complex geometry of the agglomerates is also responsible for a peculiar hierarchy of compact localized states and singularities in the density of states, which are typical for ordered fractals.

cond-mat.dis-nn

Ab initio studies of carbon dioxide affinity to carbon compounds and minerals

We have performed quantum chemical computational studies to determine carbon dioxide affinity to carbon compounds and minerals, which could be present in shales. These studies shed light on the microscopic mechanisms of the possible carbon oxide sequestration processes. Our studies reveal that the carbon oxide can be adsorbed to various forms of carbon structures and also minerals such as periclase or illite. We find out that the strongest affinity of carbon oxide towards carbon structures occurs when the carbon structures exhibit $sp^3$ bonds.

cond-mat.mtrl-sci