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鉄ポルフィリンのX線吸収分光解析
鉄ポルフィリンのX線吸収分光解析
鉄ポルフィリンのX線吸収分光解析
10T3002C
Introduction
(FeP)
(DFT)XMCD
FeP
(Hund)
!
(LS ~ 0.1 2 , 350~70)
()
() = 1
(MCD)
( = 0, 1)
Clebsch-Gordan
( = , = )
Cowan(Atomic multiplet)
(B=6T)
DFT+U
DFT(2 )()
XAS Fe L-edge
A2
XASXMCD
A2XMCD
S~
XASXMCD
EXASXMCD
XMCDnormal angleL2 L3-edge
A2E
STM,DFTvanderwaals2
?
= 1 2 + 2 (1 2 2 )
XASXMCD
XMCD
d(slater)? Or ?
CuOFeP
dipolar term
FePXAS Fe L-edgeFeP
Cu(001)
STM
Slater