G. Wiech et A. Simunek, ANALYSIS OF THE ELECTRONIC AND LOCAL-STRUCTURE OF AMORPHOUS SINXH ALLOY-FILMS IN TERMS OF SIK, SIL, AND NK X-RAY-EMISSION BANDS, Physical review. B, Condensed matter, 49(8), 1994, pp. 5398-5405
We have studied silicon-nitrogen bonding states in amorphous SiN(x):H
alloy films and in crystalline alpha-Si3N4 and beta-Si3N4 by applying
x-ray-emission spectroscopy (XES). We present x-ray Si K, Si L, and N
K emission bands of alloy films covering the concentration range 0 les
s-than-or-equal-to x less-than-or-equal-to 2.03 and identify spectral
features on the base of ab initio calculations of all emission bands o
f beta-Si3N4. The calculations delineate the role of Si 3s, 3p, and N
2s, 2p electrons in the bond and confirm the presence of silicon d-lik
e electrons in the top region of the valence band. A comparison with a
vailable ultraviolet and x-ray photoelectron spectroscopy results is g
iven. The position of the N 2s line observed in Si K and Si L emission
bands of the alloys is analyzed in terms of the random-bond and rando
m-mixture (RMM) models of nearest-neighbor structure of silicon atoms.
The results unambiguously support the RMM structure of our samples an
d demonstrate that a detailed analysis of x-ray transitions observable
in XES can yield unique and unconventional information about the loca
l structure and the degree of phase separation in a-SiN(x):H alloy fil
ms.