Research output: Chapter in Book/Report/Conference proceeding › Conference contribution
XPS and NEXAFS investigation of electronic energy structure of Ti-Ni and TiNi-Cu alloys. / Senkovskiy, B.; Usachov, D.; Chikina, A.; Ulyanov, P.; Shelyakov, A.; Adamchuk, V.K.
Materials Science Forum. Trans Tech Publications Ltd, 2013. p. 128-133.Research output: Chapter in Book/Report/Conference proceeding › Conference contribution
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TY - GEN
T1 - XPS and NEXAFS investigation of electronic energy structure of Ti-Ni and TiNi-Cu alloys
AU - Senkovskiy, B.
AU - Usachov, D.
AU - Chikina, A.
AU - Ulyanov, P.
AU - Shelyakov, A.
AU - Adamchuk, V.K.
PY - 2013
Y1 - 2013
N2 - The electronic energy structure of Ti-Ni and TiNi-Cu alloys has been studied experimentally by XPS and NEXAFS and theoretically by the full-potential local-orbital minimum-basis code. The study has revealed formation in the valence band of the Ti50Ni50 alloy of a common d-band through hybridization of the d-states of Ti with those of Ni, which is localized within a narrow binding-energy interval. This brings about an intra-atomic redistribution of Ti electron density in the Ti50Ni50 alloy compared to the pure metal: decrease of the occupancy of the Ti d-shell is countered by an increase in the number of Ti p-electrons. The occupancy of the Ti d-shell in the TiNi-Cu alloys, where Ni atoms are partially substituted by Cu, and in the Ti-Ni alloys with an excess of the Ni is more than in the equiatomic Ti50Ni50 alloy. The occupancy of the Ni and Cu d-shells in the Ti-Ni and TiNi-Cu alloys is independent of the atomic composition. The Ti d-shell sensitivity to variation of the nearest atomic environment is apparen
AB - The electronic energy structure of Ti-Ni and TiNi-Cu alloys has been studied experimentally by XPS and NEXAFS and theoretically by the full-potential local-orbital minimum-basis code. The study has revealed formation in the valence band of the Ti50Ni50 alloy of a common d-band through hybridization of the d-states of Ti with those of Ni, which is localized within a narrow binding-energy interval. This brings about an intra-atomic redistribution of Ti electron density in the Ti50Ni50 alloy compared to the pure metal: decrease of the occupancy of the Ti d-shell is countered by an increase in the number of Ti p-electrons. The occupancy of the Ti d-shell in the TiNi-Cu alloys, where Ni atoms are partially substituted by Cu, and in the Ti-Ni alloys with an excess of the Ni is more than in the equiatomic Ti50Ni50 alloy. The occupancy of the Ni and Cu d-shells in the Ti-Ni and TiNi-Cu alloys is independent of the atomic composition. The Ti d-shell sensitivity to variation of the nearest atomic environment is apparen
KW - Electronic Structure
KW - FPLO
KW - NEXAFS
KW - Shape Memory Alloy (SMA)
KW - TiNi
KW - TiNi-Cu
KW - XPS
U2 - 10.4028/www.scientific.net/MSF.738-739.128
DO - 10.4028/www.scientific.net/MSF.738-739.128
M3 - Conference contribution
SN - 9783037856109
SP - 128
EP - 133
BT - Materials Science Forum
PB - Trans Tech Publications Ltd
ER -
ID: 7379931