Shu-Jen Han, Dharmendar Reddy, et al.
ACS Nano
The non-adiabatic treatment of vibrational motion in e_-molecule scattering typically involves a sum or integral over a complete set of vibrational functions, in general including a continuum. If all functions of the vibrational coordinate are defined by interpolation on a finite point set, they can be represented as linear combinations of basis functions that are Kronecker- delta functions on this point set- Here we introduce ‘spline-delta’ basis functions with this property, providing a discrete complete set for which intermediate sums in matrix products can be closed without truncation. © 1993 IOP Publishing Ltd.
Shu-Jen Han, Dharmendar Reddy, et al.
ACS Nano
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MRS Fall Meeting 2020
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