Spin-mixed ground state of Fe phthalocyanine and the temperature-dependent branching ratio in X-ray absorption spectroscopy

1988 ◽  
Vol 149 (3) ◽  
pp. 295-299 ◽  
Author(s):  
B.T. Thole ◽  
G. Van Der Laan ◽  
P.H. Butler
1998 ◽  
Vol 62 (1) ◽  
pp. 65-75 ◽  
Author(s):  
P. F. Schofield ◽  
G. van der Laan ◽  
C. M. B. Henderson ◽  
G. Cressey

AbstractThe Fe 2p X-ray absorption spectra of single crystal gillespite, BaFeSi4O10, show a strong linear dichroism, i.e. a large difference in the absorption when measured with the polarization of the X-rays either parallel or perpendicular to the plane of the FeO4 group. The isotropic spectrum, obtained from measurement at the ‘magic angle’, and the polarization dependent spectra have been compared to atomic multiplet calculations and show an excellent agreement with theory. Analysis of the branching ratio, the linear dichroism, and the detailed peak structure confirms that the 5A1 level is the ground state at room temperature and pressure. The 5B2 level is sufficiently low in energy that a distortion of the electronic charge density, induced by increased pressure, may result in a 5B2 ground state.


2013 ◽  
Vol 21 (1) ◽  
pp. 165-169 ◽  
Author(s):  
Pengfei An ◽  
Caihao Hong ◽  
Jing Zhang ◽  
Wei Xu ◽  
Tiandou Hu

A facile heating cell has been designed forin situtransmittance and fluorescence X-ray absorption spectroscopy (XAS) measurements up to 1273 K under vacuum or an inert atmosphere. These high temperatures are achieved using a tantalum heating element by ohmic heating. Because of the small specific heat capacity, the temperature can be changed in a matter of minutes from room temperature to high temperature. Furthermore, a commercial power controller was adapted to provide stable temperature control. The construction of the heat shielding system provides a novel approach to reducing the beam's path length and the cell's size. The cell is inexpensive and easy to build. Its performance was evaluated byin situXAS measurements of the temperature-dependent structure of ceria nanocrystals. Some preliminary results for the structural mechanism in ceria nanocrystal redox applications are given.


1988 ◽  
Vol 38 (5) ◽  
pp. 3158-3171 ◽  
Author(s):  
B. T. Thole ◽  
G. van der Laan

2005 ◽  
Vol 71 (12) ◽  
Author(s):  
N. Mannella ◽  
A. Rosenhahn ◽  
M. Watanabe ◽  
B. Sell ◽  
A. Nambu ◽  
...  

1995 ◽  
Vol 52 (9) ◽  
pp. 6530-6541 ◽  
Author(s):  
J. G. Tobin ◽  
G. D. Waddill ◽  
A. F. Jankowski ◽  
P. A. Sterne ◽  
D. P. Pappas

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