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...
Main Authors: | , , , , , , , |
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Format: | Article |
Language: | English |
Published: |
American Chemical Society
2023
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Subjects: | |
Online Access: | http://eprints.utm.my/104865/1/RazifRazali2023_DFTStudiesofthePhotocatalyticProperties.pdf |