H. Ishida et A. Liebsch, ELECTRONIC EXCITATIONS IN ALKALI-METAL OVERLAYERS - I - UNRECONSTRUCTED LOW-TEMPERATURE PHASE OF LI AL/, Physical review. B, Condensed matter, 57(19), 1998, pp. 12550-12557
The influence of interband transitions on collective excitations in ad
sorbed alkali-metal layers is investigated for Li on Al in the unrecon
structed low-temperature phase. The three-dimensional Li overlayer is
described in terms of nonlocal pseudopotentials while the Al substrate
is treated within the jellium model. The finite-frequency response ap
propriate for incident photons is calculated within the time-dependent
density-functional approach. In striking contrast to previous results
for Na and K layers on Al, which reveal multipole surface and bulklik
e overlayer plasmons, we find for Li overlayers only one dominant adso
rbate-induced collective excitation associated with the Li multipole s
urface plasmon. The bulklike Li overlayer plasmon is greatly suppresse
d due to single-particle transitions induced by the Li lattice potenti
al. The theoretical spectra compare well with recent photoyield measur
ements for Li on Al(111).