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Energy decomposition analysis compounds chemical bonding

In this chapter we summarize our systematic investigations of the namre of the chemical bond in transition metal (TM) molecules [17-37] and main group compounds [37-43] employing an energy decomposition analysis (EDA) which was originally developed by Morokuma [44] for ab initio methods and by Ziegler and Rank [45] for DFT methods. The EDA method has been further developed by Baerends and coworkers... [Pg.294]


See other pages where Energy decomposition analysis compounds chemical bonding is mentioned: [Pg.433]    [Pg.291]    [Pg.26]    [Pg.215]    [Pg.556]    [Pg.188]    [Pg.429]    [Pg.625]    [Pg.407]    [Pg.408]    [Pg.135]    [Pg.424]   


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Bond energy decomposition

Bonding analysis

Chemical Compounding

Chemical analysis compounds

Chemical bond decomposition

Chemical bond energy

Chemical bonding bond energies

Chemical bonding energy

Chemical bonds energy decomposition

Chemical compounds

Chemical energy

Compound analysis

Decomposition analysis

Decomposition chemical

Decomposition energy

Energy decomposition analyses

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