Simulation of resonantly and off-resonantly excited x-ray emission spectra: An application for the [Formula Presented] scattered-wave method

Physical Review A - Atomic, Molecular, and Optical Physics

Volumn 57, Issue 6, 1998, Pages 4275-4278

  Vaterlein P ^a   Fink, R ^a   Umbach, E ^a   Wurth, W ^b  

^a UNIVERSITY OF WÜRZBURG   (Germany)

^b TECHNICAL UNIVERSITY OF MUNICH   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

BENZENE; CALCULATIONS; COMPUTER SIMULATION; ELECTRONIC STRUCTURE; ELECTRONS; MOLECULES; RAMAN SCATTERING;

RESONANT INELASTIC X RAY SCATTERING; X RAY ABSORPTION SPECTROSCOPY; X RAY EMISSION SPECTROSCOPY; X RAY FLUORESCENCE;

EMISSION SPECTROSCOPY;

EID: 0032094784     PISSN: 10502947     EISSN: 10941622     Source Type: Journal    
DOI: 10.1103/PhysRevA.57.4275     Document Type: Article

References (19)

1. C. J. Sparks, Phys. Rev. Lett. 5, 262 (1974).PRLTAO
2. A. Nilsson, P. Bennich, T. Wiell, N. Wassdahl, N. Mårtensson, J. Nordgren, O. Björneholm, and J. Stöhr, Phys. Rev. B 51, 10 244 (1995).PRBMDO
3. A. Nilsson, M. Weinelt, T. Wiell, P. Bennich, O. Karis, N. Wassdahl, J. Stöhr, and M. G. Samant, Phys. Rev. Lett. 78, 2847 (1997).PRLTAO
4. P. Skytt, J. Guo, N. Wassdahl, J. Nordgren, Y. Luo, and H. Ågren, Phys. Rev. A 52, 3572 (1995).PLRAAN
5. J. C. Slater, Adv. Quantum Chem. 6, 1 (1972).AQCHA9
6. K. H. Johnson, Adv. Quantum Chem. 7, 143 (1973).AQCHA9
7. J. Stöhr, NEXAFS Spectroscopy, edited by R. Gomer, Springer Series in Surface Science, Vol. 25 (Springer, Berlin, 1992).
8. J. C. Slater, Phys. Rev. 81, 385 (1951).PHRVAO
9. J. A. Tossell, J. Am. Chem. Soc. 97, 4940 (1975).JACSAT
10. J. A. Tossell, J. Chem. Phys. 66, 5712 (1977).JCPSA6
11. T. Åberg, Phys. Scr. 21, 495 (1990).PHSTBO
12. H. A. Kramers and W. Heisenberg, Z. Phys. 31, 681 (1925).ZEPYAA
13. L. S. Cederbaum and W. Domcke, J. Chem. Phys. 66, 5084 (1977).JCPSA6
14. J. Somers, A. W. Robinson, T. Lindner, D. Ricken, and A. M. Bradshaw, Phys. Rev. B 40, 2053 (1989).PRBMDO
15. P. S. Bagus and H. F. Schaefer, J. Chem. Phys. 56, 224 (1972).JCPSA6
16. The imperfect description of one-particle binding energies is certainly a drawback of the (Formula presented) SW method. One must not forget, however, the advantages of the method: the (unique) possibility to treat bound and free states and the potential to handle large molecules and clusters.
17. Y. Ma, F. Sette, G. Meigs, S. Modesti, and C. T. Chen, Phys. Rev. Lett. 63, 2044 (1989).PRLTAO
18. Y. Luo, H. Ågren, J. Guo, P. Skytt, N. Wassdahl, and J. Nordgren, Phys. Rev. A 52, 3730 (1995).PLRAAN
19. O. Karis et al, Phys. Rev. Lett. 76, 1380 (1996). PRLTAO