Molecular simulation of Cu, Ag, and Au-decorated Molybdenum doped graphene nanoflakes as biosensor for carmustine, an anticancer drug

CM Chima, H Louis, D Charlie, A Imojara… - Materials Science in …, 2023 - Elsevier
This study delves into the fascinating realm of molybdenum-doped graphene (Mo@ GP)
complexes, featuring captivating adsorption sites for oxygen (O) and chlorine (Cl), adorned …

Theoretical insights into benzophenone pollutants removal from aqueous solutions using graphene oxide nanosheets

S Fazli, F Buazar, A Matroudi - Theoretical Chemistry Accounts, 2023 - Springer
In this study, we investigate the adsorption behavior of three benzophenone derivatives,
namely 2, 4-Dihydroxybenzophenone (benzophenone-1; BP-1), 2, 2′, 4, 4 …

The theoretical investigation of B12As12, Al12As12, and Ga12As12 nano-cages and the effect of encapsulation of alkali metal atoms Li and Na on their electronic …

F Alirezapour, M Mohammadi - Nashrieh Shimi va Mohandesi Shimi Iran, 2024 - nsmsi.ir
This study investigates the theoretical structure, electronic properties, and photocatalytic
properties of X12As12 nano-cages (X= B, Al, Ga) and shows how their chemical and …

The Theoretical Investigation of B12As12, Al12As12, And Ga12As12 Nano-Cages and the Effect of Encapsulation of Alkali Metal Atoms Li and Na on Their Electronic …

F Alirezapour, M Mohammadi - Nashrieh Shimi va Mohandesi Shimi Iran, 2024 - nsmsi.ir
This study investigates the theoretical structure, electronic properties, and photocatalytic
properties of X12As12 nano-cages (X= B, Al, Ga) and shows how their chemical and …