The adsorption of alkali and alkaline earth ions onto the exterior surface of inorganic
nanocages X 12 Y 12 (X= B, Al, Ga and Y= N, P, As) was investigated by using the density …

The requirement of highly sensitive and selective sensors for frequent determination of toxic
gases present in the environment are a major challenge for scientific community. This work …

Graphene nanoribbons (GNRs) and graphene hybrid photodetectors were demonstrated in
the middle-and long-wavelength infrared (MWIR and LWIR, respectively) regions. Graphene …

In this work, we have designed and simulated a graphene field effect transistor (GFET) with
the purpose of developing a sensitive biosensor for methanethiol, a biomarker for bacterial …

In this work, based on density functional theory, the edge and the center of both armchair-
edged graphene nanoribbons (AGNRs) and zigzag-edged graphene nanoribbons (ZGNRs) …

The 3'-azido-3'-deoxythymidine, which is termed AZT, was introduced as anti-human
immunodeficiency virus HIV. AZT is supposed to interact with water molecules forming two …

Graphene nanoribbons (GNRs) are an emerging material for future nanoelectronic
applications. Because GNR fabrication technology is still in an early stage, modelling of …

Over the two past decades, graphene has attracted a great deal of attention for use in state-
of-the-art electronic devices. Its two-dimensional structure and good electrical and thermal …

Adatom-adsorbed graphene nanoribbons (GNRs) have gained much attention owing to the
tunable electronic and magnetic properties. The metal (Bi, Al)/transition metal (Ti, Fe, Co, Ni) …

This study aimed to explore the electronic and topological properties of nanoribbons as a
highly applicable nano-scale material. By using the first principle calculations of density …