Quantum chemical study of the electronic structure of NiCH2+ in its ground state and low-lying electronic excited states

2005 ◽  
Vol 122 (4) ◽  
pp. 044313 ◽  
Author(s):  
Sébastien Villaume ◽  
Chantal Daniel ◽  
Alain Strich ◽  
S. Ajith Perera ◽  
Rodney J. Bartlett
Keyword(s):  
Electronic Structure ◽  
Excited States ◽  
Ground State ◽  
Quantum Chemical ◽  
Quantum Chemical Study ◽  
Chemical Study ◽  
Electronic Excited States

Quantum-chemical study of the relation between electronic structure and pA2 in a series of 5-substituted tryptamines

1985 ◽  
Vol 28 (4) ◽  
pp. 421-428 ◽  
Author(s):  
J. S. Gomez-Jeria ◽  
D. Morales-Lagos ◽  
J. I. Rodriguez-Gatica ◽  
J. C. Saavedra-Aguilar
Keyword(s):  
Electronic Structure ◽  
Quantum Chemical ◽  
Quantum Chemical Study ◽  
Chemical Study

Quantum-Chemical Study of the Diatomic Hydrides Electronic Structure

1989 ◽  
Vol 22 (2) ◽  
pp. 211-236 ◽  
Author(s):  
B. F. Minaev ◽  
A. E. Buketova ◽  
Z. M. Muldahmetov
Keyword(s):  
Electronic Structure ◽  
Quantum Chemical ◽  
Quantum Chemical Study ◽  
Chemical Study

Quantum chemical study of the geometric and electronic structure of the FeC2 molecule

1999 ◽  
Vol 310 (5-6) ◽  
pp. 515-522 ◽  
Author(s):  
Alexei V. Arbuznikov ◽  
Marc Hendrickx ◽  
Luc G. Vanquickenborne
Keyword(s):  
Electronic Structure ◽  
Quantum Chemical ◽  
Quantum Chemical Study ◽  
Chemical Study
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