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Hiine, M., Ngoepe, P.E. and Maenetja, K.P.
The Effect Of Nb Doping On LiNiO2 (101) Surface: DFT+U Study
.
S. Afr. J. Ind. Eng.
, Dec 2025, vol.36, no.3, p.360-367. ISSN 2224-7890
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Sithole, N., Kgatwane, K.M. and Ngoepe, P.E.
Enhancing the Structural and Mechanical Properties of Li1.22-xNaxMn0.78O2(0.00
<
X
<
0.05) by Doping with Sodium: DFT and FHI-Aims
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S. Afr. J. Ind. Eng.
, Dec 2025, vol.36, no.3, p.351-359. ISSN 2224-7890
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Ledwaba, T.M. et al.
The effect of vanadium on the magnetic and mechanical properties of B2 FeCo alloy: a DFT approach
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J. S. Afr. Inst. Min. Metall.
, May 2024, vol.124, no.5, p.263-267. ISSN 2225-6253
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Mkhonto, C.S., Chauke, H.R. and Ngoepe, P.E.
First-principles studies of Fe-Al-X (X = Pt, Ru) alloys
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J. S. Afr. Inst. Min. Metall.
, Oct 2017, vol.117, no.10, p.963-967. ISSN 2225-6253
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