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Ashraf, Muhammmad Aqeel and Liu, Zhenling and Najafi, Meysam (2020) DFT study of CN oxidation (CN+1/2O(2) -> OCN) on the surfaces of chromium-doped nanotubes (Cr-CNT (8, 0) and Cr-BNNT (8,0)). Russian Journal of Physical Chemistry B, 14 (2). pp. 217-221. ISSN 1990-7931, DOI https://doi.org/10.1134/S1990793120020189.
Ashraf, Muhammad Agee and Li, Cheng and Zhang, Dangquan and Najafi, Meysam (2020) A theoretical investigation on the potential of copper- and zinc-doped nanotubes as catalysts for the oxidation of SO2 (SO2+1/2O(2) -> SO3) and CO (CO+1/2O(2) -> CO2). Journal of Computational Electronics, 19 (1). pp. 55-61. ISSN 1569-8025, DOI https://doi.org/10.1007/s10825-019-01418-z.
