سال انتشار: ۱۳۹۱

محل انتشار: اولین همایش ملی تصفیه آب و پساب های صنعتی

تعداد صفحات: ۲

نویسنده(ها):

Kourosh motevalli – Department of Applied Chemistry, Islamic Azad University, South Tehran Branch, Tehran, Iran
Zahra yaghoubi – Faculty of Industrial Engineering, Islamic Azad University, South Tehran Branch, Tehran, Iran

چکیده:

In This Paper , A complete Survey Upon The Atomistic simulation is presented . As We know , this method is a powerful tool to probe the structure and properties of materials and the nature of chemical reactions. Corrosion is a complex process that involves chemical reactions occurring at the interface between a material and its environment and is, therefore, highly suited to study by atomistic modeling techniques. In this paper, the perplex nature of corrosion processes is studied. Also, In this paper, Several instances of the application of atomistic modeling to corrosion science are surveyed in detail, including studies of the metal-water interface, the reaction of water on electrified metallic interfaces, the dissolution of metal atoms from metallic surfaces, and the role of competitive adsorption in controlling the chemical nature and structure of a metallic surface, are all the works which were performed in this research