P.S. Bagus, K. Hermann
Physical Review B
Analysis of ab initio cluster wave functions show that the shifts in the vibrational frequencies of CO/Cu and CN/Cu due to an applied electric field arise dominantly from a Stark effect. The CN bonding is largely ionic while CO has a dative covalent bond. Consequently the Stark effect mechanisms are significantly different. © 1987 The American Physical Society.
P.S. Bagus, K. Hermann
Physical Review B
K. Hermann, P.S. Bagus
Applied Surface Science
P.S. Bagus, C.J. Nelin, et al.
Physical Review B
G. Pacchioni, P.S. Bagus, et al.
International Journal of Quantum Chemistry