DFT studies of the photocatalytic properties of MoS2-doped boron nitride nanotubes for hydrogen production

DFT studies of the photocatalytic properties of MoS2-doped boron nitride nanotubes for hydrogen production

This study investigated the photocatalytic properties of MoS2-doped boron nitride nanotubes (BNNTs) for overall water splitting using popular density functional theory (DFT). Calculations of the structural, mechanical, electronic, and optical properties of the investigated systems were performed usi...

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Bibliographic Details
Main Authors: Itas, Yahaya Saadu, Suleiman, Abdussalam Balarabe, Ndikilar, Chifu E., Lawal, Abdullahi, Razali, Razif, Ullah, Md. Habib, Osman, Hamid, Khandaker, Mayeen Uddin
Format: Article
Language:English
Published: American Chemical Society 2023
Subjects:
QC Physics
Online Access:http://eprints.utm.my/104865/1/RazifRazali2023_DFTStudiesofthePhotocatalyticProperties.pdf

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