Direct subsurface absorption of hydrogen on Pd(111): Quantum mechanical calculations on a new

Olsen, R. A.; Philipsen, P. H. T.
June 1997
Journal of Chemical Physics;6/8/1997, Vol. 106 Issue 22, p9286
Academic Journal
Discusses the calculation of a two-dimensional potential energy surface (PES) for hydrogen interacting with a palladium (Pd) surface. Use of both the local density approximation and generalized gradient approximation for density functional calculations; Direct subsurface absorption probability.


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