scholarly journals Dissociation energy and electronic structure of the low valent lanthanide compound NdF+

2016 ◽  
Vol 116 (10) ◽  
pp. 791-794 ◽  
Author(s):  
Christopher South ◽  
George Schoendorff ◽  
Angela K. Wilson
Keyword(s):  
Electronic Structure ◽  
Dissociation Energy ◽  
Lanthanide Compound ◽  
Low Valent

Effect of low-valent atom substitution on electronic structure and magnetic properties of Fe1.5M0.5CoSi (M=V, Cr, Mn, Fe) Heusler alloys

2011 ◽  
Vol 323 (17) ◽  
pp. 2323-2327 ◽  
Author(s):  
Hongzhi Luo ◽  
Fanbin Meng ◽  
Yanqiang Cai ◽  
Wangwen Hong ◽  
Enke Liu ◽  
...  
Keyword(s):  
Magnetic Properties ◽  
Electronic Structure ◽  
Heusler Alloys ◽  
Low Valent

scholarly journals Low-Valent Iron Mono-Diazadiene Compounds: Electronic Structure and Catalytic Application

ACS Catalysis ◽  
2015 ◽  
Vol 5 (10) ◽  
pp. 6230-6240 ◽  
Author(s):  
Crispin Lichtenberg ◽  
Mario Adelhardt ◽  
Thomas L. Gianetti ◽  
Karsten Meyer ◽  
Bas de Bruin ◽  
...  
Keyword(s):  
Electronic Structure ◽  
Catalytic Application ◽  
Low Valent

scholarly journals Electronic structure of iron dinitrogen complex [(TPB)FeN2]2−/1−/0: correlation to Mössbauer parameters

RSC Advances ◽  
2020 ◽  
Vol 10 (13) ◽  
pp. 7948-7955
Author(s):  
Nidhi Vyas ◽  
Aditya Kumar ◽  
Animesh K. Ojha ◽  
Abhinav Grover
Keyword(s):  
Density Functional Theory ◽  
Electronic Structure ◽  
Density Functional ◽  
Spectroscopic Analysis ◽  
Functional Theory ◽  
Mössbauer Parameters ◽  
Low Valent ◽  
Dinitrogen Complex

We use density functional theory studies to explore the electronic structure, bonding and spectroscopic analysis of a low-valent iron (2−/1−/0) complex [(TPB)FeN2]2−/1−/0 and reveled the factor which affects the reactivity of the metal–dinitrogen moiety.

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