Inclusion of local structure effects in theoretical x-ray resonant scattering amplitudes using ab initio x-ray-absorption spectra calculations

Physical Review B - Condensed Matter and Materials Physics

Volumn 58, Issue 17, 1998, Pages 11215-11225

  Cross, J ^a   Newville, M ^b  

^a NAVAL RESEARCH LABORATORY   (United States)

^b LAWRENCE LIVERMORE NATIONAL LABORATORY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0001575668     PISSN: 10980121     EISSN: 1550235X     Source Type: Journal    
DOI: 10.1103/PhysRevB.58.11215     Document Type: Article

References (43)

1. J. Karle, Int. J. Quantum Chem. 7, 357 (1980).
2. W. A. Hendrickson, Science 254, 51 (1991).
3. H. Stragier, J. O. Cross, J. J. Rehr, L. B. Sorensen, and J. C. Woicik, Phys. Rev. Lett. 69, 3064 (1992).
4. L. B. Sorensen et. al in Resonant Anomalous X-Ray Scattering: Theory and Applications, edited by G. Materlik, C. J. Sparks, and K. Fischer (North-Holland, Amsterdam, 1994), pp. 389-420.See Ref. 1.
5. I. J. Pickering, M. Sansone, J. Marsch, and G. N. George, J. Am. Chem. Soc. 115, 6302 (1993).
6. L. G. Parratt and C. F. Hempstead, Phys. Rev. 94, 1593 (1954).
7. D. T. Cromer and D. Liberman, J. Chem. Phys. 53, 1891 (1970).
8. J. Bohr, D. Gibbs, and K. Huang, Phys. Rev. B 42, 4322 (1990).
9. D. H. Templeton and L. K. Templeton, Phys. Rev. B 49, 14 850 (1994).
10. E. A. Stern and S. M. Heald, in Handbook of Synchrotron Radiation, edited by E. E. Koch (North-Holland, New York, 1983).
11. J. J. Rehr, J. M. de Leon, S. I. Zabinsky, and R. C. Albers, J. Am. Chem. Soc. 113, 5136 (1991).
12. S. I. Zabinsky et. al Phys. Rev. B 52, 2995 (1995).
13. J. J. Sakurai, Advanced Quantum Mechanics (Addison-Wesley, Menlo Park, CA, 1997).
14. S. Sasaki, KEK Report No. 88-14, 1989 (unpublished).
15. S. Ramaseshan, T.G. Ramesh, and G. S. Ranganath, in Anomalous Scattering, edited by S. Ramaseshan and S.C. Abrahams (Munksgaard, Copenhagen, 1975), pp. 139-161.
16. M. Goldberger and K. M. Watson, Collision Theory (Wiley, New York, 1964).
17. L. K. Templeton and D. H. Templeton, J. Appl. Crystallogr. 21, 558 (1988).
18. L. Kissel et. al Acta Crystallogr., Sect. A: Found. Crystallogr. 51, 271 (1995).
19. K. Ohta and H. Ishida, Appl. Spectrosc. 42, 952 (1988).
20. O. Keski-Rahkonen and M. O. Krause, At. Data Nucl. Data Tables 14, 140 (1974).
21. S. Brennan and P. L. Cowan, Rev. Sci. Instrum. 63, 850 (1992).
22. M. F. Toney et. al Phys. Rev. Lett. 75, 4472 (1993).
23. J. A. Golovchenko, R. A. Levesque, and P. L. Cowan, Rev. Sci. Instrum. 52, 509 (1981).
24. B. D. Cullity, Elements of X-Ray Diffraction (Addison-Wesley, Menlo Park, CA, 1978).
25. N. W. Ashcroft and N. D. Mermin, Solid State Physics (Holt, Rinehart and Winston, New York, 1976).
26. R. W. James, The Optical Principles of the Diffraction of X-rays (Ox Bow Press, Woodbridge, CT, 1962).
27. J. D. Jorgensen et. al Phys. Rev. B 41, 1863 (1990).
28. C. Y. Yang et. al Phys. Rev. B 38, 6568 (1988).
29. D. Haskel (private communication).
30. D. H. Templeton and L. K. Templeton, Acta Crystallogr., Sect. A: Found. Crystallogr. 47, 414 (1991).
31. C. E. Bouldin, L. B. Sorensen, H. J. Stragier, and B. D. Ravel (unpublished).
32. D. Gibbs, J. Less-Common Met. 148, 109 (1989).
33. W. G. Stirling and G. H. Lander, J. Appl. Phys. 73, 6877 (1993).
34. C. Detlefs et. al Phys. Rev. B 55, R680 (1997).
35. G. M. Watson et. al Phys. Rev. Lett. 77, 751 (1996).
36. G. M. Watson et. al Phys. Rev. B 53, 686 (1996).
37. B. L. Henke, E. M. Gullikson, and J. C. Davis, At. Data Nucl. Data Tables 54, 181 (1993); tabulated data are available on-line at http://xray.uu.se/hypertext/ptable.html.
38. D. H. Templeton and L. K. Templeton, Acta Crystallogr., Sect. A: Found. Crystallogr. 48, 746 (1992).
39. M. Newville et. al (unpublished).
40. D. Rez, P. Rez, and I. Grant, Acta Crystallogr., Sect. A: Found. Crystallogr. 50, 481 (1994).
41. A. L. Ankudinov (private communication).
42. J. Rehr, R. Albers, and S. Zabinsky, Phys. Rev. Lett. 69, 3397 (1992).
43. K. Göttfried, Quantum Mechanics (Benjamin, New York, 1966).