Effect of Electric Field on Defected Graphene Quantum Dot: A DFT Study

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عنوان دوره: اولین همایش ملی توسعه فناوری نانو در علوم پایه و مهندسی
کد مقاله : 1041-DNBSE
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دانشگاه آزاد واحد تهران مرکز
چکیده
Graphene doping with heteroatoms improves their catalytic activity than the reactions required to store or convert energy. As a result, the study tries to classify defects, emphasize their importance, and introduce common ways to study and identify them, and propose new ways to build new nutrient-based devices, such as graphene defect. The presence of an electric field in defective graphene compounds is an emerging field of research with many potential applications in the industry, such as gas purification, gas sensors, batteries and fuel cells. In this work, we studied the interaction of Helium on central defective graphene sheet in present of several electric field were investigated by means of first-principles based on density functional theory
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