Acrylate Formation from CO2 and Ethylene Mediated by Nickel Complexes: A Theoretical Study

2014 ◽  
Vol 33 (14) ◽  
pp. 3657-3668 ◽  
Author(s):  
Philipp N. Plessow ◽  
Ansgar Schäfer ◽  
Michael Limbach ◽  
Peter Hofmann
Keyword(s):  
Theoretical Study ◽  
Nickel Complexes

Spectroscopic aspects of the coordination modes of 2,4-dithiohydantoins: Experimental and theoretical study on copper and nickel complexes of cyclohexanespiro-5-(2,4-dithiohydantoin)

2010 ◽  
Vol 363 (14) ◽  
pp. 3919-3925 ◽  
Author(s):  
Anife Ahmedova ◽  
Petja Marinova ◽  
Katarzyna Paradowska ◽  
Neyko Stoyanov ◽  
Iwona Wawer ◽  
...  
Keyword(s):  
Theoretical Study ◽  
Nickel Complexes ◽  
Coordination Modes

scholarly journals Theoretical study of cobalt and nickel complexes involved in methyl transfer reactions: structures, redox potentials and methyl binding energies

2019 ◽  
Vol 30 (5) ◽  
pp. 1957-1970
Author(s):  
Patrycja Sitek ◽  
Aleksandra Chmielowska ◽  
Maria Jaworska ◽  
Piotr Lodowski ◽  
Marzena Szczepańska
Keyword(s):  
Theoretical Study ◽  
Nickel Complexes ◽  
Binding Energies ◽  
Transfer Reactions ◽  
Redox Potentials ◽  
Methyl Transfer ◽  
Cobalt And Nickel

Theoretical Study of the Mechanism of Carbonyl Insertion Reactions Catalyzed by Nickel Complexes

2000 ◽  
Vol 19 (11) ◽  
pp. 2170-2178 ◽  
Author(s):  
Fernando Bernardi ◽  
Andrea Bottoni ◽  
Marco Nicastro ◽  
Ivan Rossi ◽  
Juan Novoa ◽  
...  
Keyword(s):  
Theoretical Study ◽  
Nickel Complexes ◽  
Insertion Reactions

Theoretical Study on Second Hyperpolarizabilities of Singlet Diradical Square Planar Nickel Complexes Involvingo-Semiquinonato Type Ligands

2008 ◽  
Vol 112 (36) ◽  
pp. 8423-8429 ◽  
Author(s):  
Hitoshi Fukui ◽  
Ryohei Kishi ◽  
Takuya Minami ◽  
Hiroshi Nagai ◽  
Hideaki Takahashi ◽  
...  
Keyword(s):  
Theoretical Study ◽  
Nickel Complexes ◽  
Square Planar

A theoretical study on charge transport of dithiolene nickel complexes

2016 ◽  
Vol 18 (8) ◽  
pp. 6259-6267 ◽  
Author(s):  
Vu Thi Thu Huong ◽  
Truong Ba Tai ◽  
Minh Tho Nguyen
Keyword(s):  
Charge Transport ◽  
Theoretical Study ◽  
Nickel Complexes ◽  
Dft Methods ◽  
Chemical Structures

The effect of chemical structures on the charge transport characteristics of dithiophene nickel complexes was studied using DFT and NEGF-DFT methods.

Sign in / Sign up

Export Citation Format

Share Document