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Showing 8 out of a total of 8 results for collection: Research Articles (University of Pretoria).
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Ab-initio study of MgSe self-interstitial (Mgi and Sei)
Igumbor, Emmanuel
;
Obodo, Kingsley Onyebuchi
;
Meyer, Walter Ernst
(
Trans Tech Publications
,
2016
)
A first principle hybrid functional calculation of TmGe 3+-VGe defect complexes in germanium
Igumbor, Emmanuel
;
Mapasha, Refilwe Edwin
;
Andrew, Richard Charles
;
Meyer, Walter Ernst
(
Elsevier
,
2016-09
)
Defect charge states in Si doped hexagonal boron-nitride monolayer
Mapasha, Refilwe Edwin
;
Molepo, Mahlanga P.
;
Andrew, Richard Charles
;
Chetty, Nithaya
(
IOP Publishing
,
2016-02
)
Ab-initio study of germanium di-interstitial using a hybrid functional (HSE)
Igumbor, Emmanuel
;
Ouma, C.N.M.
;
Webb, Geoffrey
;
Meyer, Walter Ernst
(
Elsevier
,
2016-01
)
Synthesis and structure of novel triphenylarsine-substituted tungsten(0) Fischer carbene complexes
Jansen van Rensburg, Armand
;
Landman, Marile
;
Van Rooyen, Petrus H.
;
Conradie, Marrigje M.
;
Conradie, Jeanet
(
Elsevier
,
2016-02
)
Ab initio studies of isolated hydrogen vacancies in graphane
Mapasha, Refilwe Edwin
;
Molepo, Mahlanga P.
;
Chetty, Nithaya
(
Elsevier
,
2016-05
)
Exploring the stability and electronic structure of beryllium and sulphur co-doped graphene : a first principles study
Olaniyan, Okikiola
;
Mapasha, Refilwe Edwin
;
Momodu, Damilola Y.
;
Madito, M.J. (Moshawe)
;
Kahleed, A.A.
;
Ugbo, F.U.
;
Bello, Abdulhakeem
;
Barzegar, Farshad
;
Oyedotun, Kabir Oyeniran
;
Manyala, Ncholu I.
(
Royal Society of Chemistry
,
2016-09
)
The carbon-substitutional-carbon-interstitial (CsCi) defect pair in silicon from hybrid functional calculations
Ouma, C.N.M.
;
Meyer, Walter Ernst
(
Elsevier
,
2016-06
)
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Mapasha, Refilwe Edwin (4)
Meyer, Walter Ernst (4)
Igumbor, Emmanuel (3)
Andrew, Richard Charles (2)
Chetty, Nithaya (2)
Molepo, Mahlanga P. (2)
Ouma, C.N.M. (2)
Barzegar, Farshad (1)
Bello, Abdulhakeem (1)
Conradie, Jeanet (1)
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Density functional theory (DFT) (8)
Charge state (4)
Defects (3)
Interstitial (2)
Carbon-substitutional–carbon-interstitial (CsCi) (1)
Charge (1)
Conformations (1)
Defect (1)
Electronic structure (1)
Fermi level (1)
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Date Issued
2016 (8)
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