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Showing 10 out of a total of 26 results for community: Chemistry.
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A density functional theory- and atoms in molecules-based study of NiNTA and NiNTPA complexes toward physical properties controlling their stability. A new method of computing a formation constant
Cukrowski, Ignacy
;
Govender, Krishna Kuben
(
American Chemical Society
,
2010-08
)
Conformation of a MnCP(CO)2-thienothiophene carbene complex : a spectroscopic and computational study
Landman, Marile
;
Barnard, Werner
;
Van Rooyen, Petrus H.
;
Liles, David C.
(
Elsevier
,
2012-08
)
A computational study of the succinimide derivative surfactant
Kovalchuk, K.
;
Landman, Marile
;
Masalova, I.
(
Taylor & Francis
,
2013
)
Physical nature of interactions in ZnII complexes with 2,2′-bipyridyl : quantum theory of atoms in molecules (QTAIM), interacting quantum atoms (IQA), noncovalent interactions (NCI), and extended transition state coupled with natural orbitals for chemical valence (ETS-NOCV) comparative studies
Cukrowski, Ignacy
;
De Lange, Jurgens Hendrik
;
Mitoraj, Mariusz Pawel
(
American Chemical Society
,
2014-01
)
Conformation analysis of triphenylphosphine in trans and cis triphenylphosphine-substituted Fischer carbene complexes
Landman, Marile
;
Levell, Tamzyn J.
;
Van Rooyen, Petrus H.
;
Conradie, Jeanet
(
Elsevier
,
2014-05
)
Electrochemical behaviour and structure of novel phosphine- and phosphite-substituted tungsten(0) Fischer carbene complexes
Landman, Marile
;
Pretorius, René
;
Fraser, Roan
;
Buitendach, Blenerhassit E.
;
Conradie, Marrigje M.
;
Van Rooyen, Petrus H.
;
Conradie, Jeanet
(
Elsevier
,
2014-06
)
E versus Z isomers of Fischer aminocarbene complex [Mo(CO)4(PPh3){C(NHCy)(2-furyl)}] : Nsingle bondH⋯O versus Csingle bondH⋯O intramolecular hydrogen bonds
Landman, Marile
;
Conradie, Jeanet
(
Elsevier
,
2015-08
)
Electrochemistry of Triphenylarsine-substituted Tungsten(0) Fischer carbene complexes
Jansen van Rensburg, Armand
;
Landman, Marile
;
Van der Westhuizen, Deidre
;
Conradie, Marrigje M.
;
Conradie, Jeanet
(
Elsevier
,
2015-12
)
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
)
Orientation of trimethylolethane cyclic phosphite in rhodium complexes : structure of [Rh(CH3COCHCOCH3)(CO)(P(OCH2)3CCH3)]
Van Rooyen, Petrus H.
;
Conradie, Jeanet
(
Elsevier
,
2016-06
)
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Conradie, Jeanet (16)
Van Rooyen, Petrus H. (15)
Landman, Marile (12)
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Jansen van Rensburg, Armand (4)
Conradie, Marrigje Marianne (3)
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Malan, F.P. (Frederick) (3)
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Density functional theory (DFT) (26)
Fischer carbene (9)
Quantum theory of atoms in molecules (QTAIM) (6)
Natural bond orbital (NBO) (5)
Structure (5)
Electrochemistry (4)
Rhodium (4)
Tungsten (4)
b-Diketone (3)
Molybdenum (3)
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