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Information × Registration Number 0211U001034, 0110U006065 , R & D reports Title The development and application of the theoretical and computer simulation approaches for prediction of nanoclusters, macromolecules and colloids behaviour popup.stage_title Head Mryglod Ihor, Registration Date 13-01-2011 Organization Institute for Condensed Matter Physics of the National Academy of Sciences of Ukraine popup.description2 Theoretical and computer methods are developed for the description of the different type nanosystems. Using quantum-chemical methods and density functional theory the structure of the hydrogen-passivated silicon surface (a typical situation at manufacturing of nanopore silicon) is investigated and possible sites of copper adsorption on this surface are revealed. The original algorithm of modeling of electrochemical etching of silicon and pore forming was proposed. Using mesoscopic modeling the nanostructures of copolymers were investigated. Product Description popup.authors Ільницький Ярослав Миколайович Брик Тарас Михайлович Мисакович Тарас Степанович Павленко Наталія Ігорівна Пацаган Оксана Вадимівна Пацаган Тарас Миколайович popup.nrat_date 2020-04-02 Close