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The FKPP wave front as a sensor of perturbed diffusion in concentrated systems
(American Physical Society, 2019-02-11)
The sensitivity to perturbations of the Fisher and Kolmogorov, Petrovskii, Piskunov front is used to find a quantity revealing perturbations of diffusion in a concentrated solution of two chemical species with different ...
Engineering of Perovskite Materials Based on Formamidinium and Cesium Hybridization for High-Efficiency Solar Cells
(American Chemical Society, 2019)
Engineering the chemical composition of inorganic–organic hybrid perovskite materials is an effective strategy to boost the performance and operational stability of perovskite solar cells (PSCs). Among the diverse family ...
Electrical Double Layers Close to Ionic Liquid–Solvent Demixing
(American Chemical Society, 2018-12-31)
Electrical double layers (EDLs) play a key role in energy storage and have been suggested to have applications in energy generation. Recently, there has been an expansion of interest in EDLs, but EDLs with ionic liquid–solvent ...
The influence of confinement on the structure of colloidal systems with competing interactions
(Royal Society of Chemistry, 2020)
Colloidal systems with competing interactions have a complex phase diagram with several periodic microphases, in which particles are arranged in lamellae, cylinders or clusters. Using grand canonical Monte Carlo simulations, ...
Shape Transformations of Vesicles Induced by Their Adhesion to Flat Surfaces
(American Chemical Society, 2020)
The shape transformations of lipid vesicles induced by the adhesion to a flat surface is investigated. We perform the calculations within the framework of the Helfrich spontaneous curvature model. The calculations were ...
Model of an Artificial Blastula for Assessing Development Toxicity
(Intechopen, 2023-03-04)
We are concerned with computer simulations of a ring of 20 coupled CSTRs with
glycolytic oscillatory reaction. Each CSTR represents an artificial cell, and the ring can
be regarded as an artificial blastula. The cells ...
Ion Complexation Explains Orders of Magnitude Changes in the Equilibrium Constant of Biochemical Reactions in Buffers Crowded by Nonionic Compounds
(ASC Publications, 2022-01-13)
The equilibrium constant (K) of biochemical complex formation in aqueous buffers with high concentration (>20 wt %) of nonionic compounds can vary by orders of magnitude in comparison with the K in a pure buffer. The precise ...
Assembly of Helical Structures in Systems with Competing Interactions under Cylindrical Confinement
(American Chemical Society, 2019)
The behavior under confinement of nanoparticles interacting with the short-range attraction and long-range repulsion potential is studied by means of Monte Carlo simulations in the grand canonical ensemble. The study is ...
Engineering of Perovskite Materials Based on Formamidinium and Cesium Hybridization for High-Efficiency Solar Cells
(American Chemical Society, 2019)
Engineering the chemical composition of
inorganic−organic hybrid perovskite materials is an effective
strategy to boost the performance and operational stability of
perovskite solar cells (PSCs). Among the diverse family ...
A new look at molecular and electronic structure of homoleptic diiron(II,II) complexes with N,N-bidentate ligands: Combined experimental and theoretical study
(Wiley, 2022)
Paddlewheel-type dinuclear complexes featuring metal–metal bonding have been the subject of widespread interest due to fundamental interest in their electronic structures and potential applications. Here, we explore the ...