First-principle studies of the structural, electronic, and optical properties of double-walled carbon boron nitride nanostructures heterosystem under various interwall distances.

• Main Authors: Saadu Itas, Yahaya, Suleiman, Abdussalam Balarabe, Ndikilar, Chifu E., Lawal, Abdullahi, Razali, Razif, Idowu, Ismail Ibrahim, Uddin Khandaker, Mayeen, Danmadami, Amina Muhammad, Ahmad, Pervaiz, Emran, Talha, Iqbal Faruque, Mohammad Rashed
• Format: Article
• Language: English
• Published: Hindawi Limited 2023
• Subjects: Q Science (General); QC Physics
• Online Access: http://eprints.utm.my/106347/1/RazifRazali2023_FirstPrincipleStudiesoftheStructuralElectronicandOptical.pdf; http://eprints.utm.my/106347/; http://dx.doi.org/10.1155/2023/4574604

Structural, electronic, and optical properties of a new combined system of carbon and boron nitride nanotubes are studied using the DFT first principles as implemented in Quantum ESPRESSO codes. The corrections to the quasi-particle energies were studied via GW hybrid functional implemented in the Y...