Pirimidin türevlerinin grafen oksit üzerine adsorpsiyonunun DFT araştırması

Yıl 2023, Cilt: 3 Sayı: 2, 32 - 38, 21.11.2023

Esvet Akbaş

Öz

Son zamanlarda biyomedikal uygulamalarda grafen oksitin nano-biyo malzeme olarak kullanımı oldukça yaygınlaşmaktadır. Özellikle akıllı tıp ve gen teknolojisinde grafen bazlı malzemelerin kullanımı üzerine yoğun çalışmalar başlatılmıştır. Bu çalışmada, ticari olarak temin edilebilen pirimidin türevi bileşiklerin elektronik özellikleri ve grafen oksitin nano-kafesindeki adsorpsiyonu, yoğunluk fonksiyonel teorisi (DFT) kullanılarak hesaplanmıştır.

Anahtar Kelimeler

Grafen oksit, nano-biyometaryal, biyomedikal

A comprehensive DFT investigation of the adsorption of pyrimidine derivatives onto graphene

Öz

Kaynakça

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