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Information × Registration Number 0219U001782, 0114U000353 , R & D reports Title Intermolecular interactions in gases, liquids and melts popup.stage_title Head Soloviev Veniamin Vasilievich, Registration Date 28-02-2019 Organization Poltava National Technical Yuri Kondratyuk University popup.description2 Object of study: ionic melts containing tungstate and molybdates; endogenous antioxidants and free radicals; ionized gas environments. Purpose: development on the basis of quantum theory of molecules, microscopic theory of the mechanism of formation of EA and multielectronic processes of electrical renewal within the framework of the cation-anionic interactions model taking into account the main factors of influence: the acid-base properties of the medium, the adsorption properties of the surface of the electrode and the electric field in ionic melts, solutions and gas sparks. A theoretical study was conducted in the framework of the non-empirical version of the method of SUE MO LKAO using the packages of programs GAMESS and HyperChem7. Analysis of electrophysical processes of ionization of media. Creation of constructively simple and technologically effective ionizers of environments, the basis of which is the principle of ionic wind, the effect of Bifeld-Brown, corona discharge, ultraviolet radiation. On the basis of the pre-developed microscopic theory of interparticle interactions and electro-renewal processes in ionic melts, the fundamental principle of acid-base catalysis has been developed. On the basis of the analysis of the results of calculations of the characteristics of cation-anion interactions and charge transfer processes in the EAC restoration reactions taking into account the influence of the factors: the acid-base properties of the medium, the electrode surface and the electric field, the theoretically proved the priority effect of the cationic composition of the electrolyte and the mechanism of EAC formation and their reactivity, which allows to predict the direction of the processes of electrical rejuvenation of the EA and the means of control of these processes. The quantum chemical evaluation of the alternation of the stage of multielectronic processes of the EWR renewal has been carried out, which has revealed the priority of the simultaneous six-electron recovery over the fast-acting cationized forms of EA. The results of the study of the mechanism of interaction of molecules of melatonin and glutathione with free radicals have allowed to substantiate the nature of endoecological processes in the system of protecting the human body from the aggressive action of free radicals, and at the same time - gave an opportunity to substantiate both the positive effect of the use of MLT and GSH on the molecular level, and to establish a potential the significance of the use of these substances as a medicinal product. The analysis of ionization and decontamination systems was carried out. The efficiency of using ionizing systems in creating a microclimate in industrial premises and for presentive stimulation of seeds is proved. The theoretical principles of the ion wind creation process are highlighted. A new construction of ionization equipment has been developed. Suggested ways to disinfect air. The results of the work allow to broaden the existing ideas about general principles of the structure of ionic melts, the mechanism of formation of EAF and control of electrode processes, which opens the prospects for expanding the scope of practical use of ionic melts as a reaction medium for the inorganic and organic compounds, for the realization of processes in high-temperature current sources, in branches of electrometallurgy, electroplating, etc. The main results of the work are presented in 80 publications. Product Description popup.authors Кузнєцова Тетяна Юріївна Петровський Олександр Миколайович Соловйов Веніамін Васильович Соляник Людмила Олексіївна popup.nrat_date 2020-04-02 Close