scholarly journals Nature and strength of chalcogen–π bonds

2018 ◽  
Vol 20 (43) ◽  
pp. 27592-27599 ◽  
Author(s):  
Marco Bortoli ◽  
Shah Masood Ahmad ◽  
Trevor A. Hamlin ◽  
F. Matthias Bickelhaupt ◽  
Laura Orian
Keyword(s):  
Molecular Orbital ◽  
Model Systems ◽  
Bonding Mechanism ◽  
Molecular Orbital Theory ◽  
Energy Decomposition ◽  
Orbital Theory ◽  
Decomposition Scheme

We have analyzed the chalcogen–π bonding mechanism in a systematic series of model systems through Kohn–Sham molecular orbital theory and a quantitative energy decomposition scheme.

Bonding in Transition Metal Silyl Dimers. Molecular Orbital Theory

1989 ◽  
Author(s):  
Alfred B. Anderson ◽  
Paul Shiller ◽  
Eugene A. Zarate ◽  
Claire A. Tessier-Youngs ◽  
Wiley J. Youngs
Keyword(s):  
Transition Metal ◽  
Molecular Orbital ◽  
Molecular Orbital Theory ◽  
Orbital Theory

scholarly journals A Molecular Orbital Theory of Reactivity in the Hydrogen Migration Polymerization of Acrylamides

1966 ◽  
Vol 87 (1) ◽  
pp. 20-26,A1 ◽  
Author(s):  
Teijiro YONEZAWA ◽  
Kiyoshi SHIMIZU ◽  
Hiroshi KATO ◽  
Kenichi FUKUI
Keyword(s):  
Molecular Orbital ◽  
Molecular Orbital Theory ◽  
Orbital Theory ◽  
Hydrogen Migration
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