Interaction of Benzene with Transition Metal Cations: Theoretical Study of Structures, Energies, and IR Spectra

2009 ◽  
Vol 5 (6) ◽  
pp. 1709-1717 ◽  
Author(s):  
Hai-Bo Yi ◽  
Han Myoung Lee ◽  
Kwang S. Kim
Keyword(s):  
Transition Metal ◽  
Ir Spectra ◽  
Theoretical Study ◽  
Metal Cations ◽  
Transition Metal Cations

scholarly journals Theoretical study of ternary silver fluorides AgMF4 (M = Cu, Ni, Co) formation at pressures up to 20 GPa

RSC Advances ◽  
2021 ◽  
Vol 11 (41) ◽  
pp. 25801-25810
Author(s):  
Mateusz A. Domański ◽  
Mariana Derzsi ◽  
Wojciech Grochala
Keyword(s):  
Transition Metal ◽  
Theoretical Study ◽  
Metal Cations ◽  
Transition Metal Cations

Only several compounds bearing the Ag(ii) cation and other paramagnetic transition metal cations are known experimentally. Here, we predict as yet unknown AgMF4 phases and their stability in function of pressure.

Theoretical Study of Two-State Reactivity of Transition Metal Cations:  The “Difficult” Case of Iron Ion Interacting with Water, Ammonia, and Methane

2004 ◽  
Vol 108 (6) ◽  
pp. 1069-1081 ◽  
Author(s):  
Sandro Chiodo ◽  
Olga Kondakova ◽  
Maria del Carmen Michelini ◽  
Nino Russo ◽  
Emilia Sicilia ◽  
...  
Keyword(s):  
Transition Metal ◽  
Theoretical Study ◽  
Metal Cations ◽  
Difficult Case ◽  
Iron Ion ◽  
Transition Metal Cations
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