Квантовохімічне моделювання протолітичної рівноваги гістаміну при взаємодії з поверхнею кремнезему

Quantum chemical analysis of the structure and protolytic properties of the species probably formed at the silica-water interface involving histamine molecule has been carried out by means of density functional theory method with use of expanded basis set.

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Bibliographic Details
Date:2012
Main Authors: Кravchenkо, A. A., Grebenyuk, A. G., Lobanov, V. V., Demianenko, E. M.
Format: Article
Language:Ukrainian
Published: Chuiko Institute of Surface Chemistry National Academy of Sciences of Ukraine 2012
Online Access:https://surfacezbir.com.ua/index.php/surface/article/view/471
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Journal Title:Surface
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Surface