Going beyond the dipole approximation to improve the refinement of magnetic structures by neutron diffraction

Physical Review B - Condensed Matter and Materials Physics

Volumn 79, Issue 14, 2009, Pages

  Rotter, M ^a   Boothroyd, A T ^a  

^a UNIVERSITY OF OXFORD   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 65549105372     PISSN: 10980121     EISSN: 1550235X     Source Type: Journal    
DOI: 10.1103/PhysRevB.79.140405     Document Type: Article

References (33)

1. F. Givord, J. Phys.: Condens. Matter 16, 1211 (2004). 10.1088/0953-8984/16/8/007
2. K. Kuwahara, J. Phys. Soc. Jpn. 76, 093702 (2007). 10.1143/JPSJ.76.093702
3. J. Schweizer, J. Phys.: Condens. Matter 20, 135204 (2008). 10.1088/0953-8984/20/13/135204
4. S. Shamoto, Phys. Rev. B 48, 13817 (1993). 10.1103/PhysRevB.48.13817
5. A. Longmore, Phys. Rev. B 53, 9382 (1996). 10.1103/PhysRevB.53.9382
6. M. Rotter, MCPHASE, a software package for the calculation of phase diagrams and magnetic properties of rare-earth systems (2002-2008), available at http://www.mcphase.de
7. M. Rotter, J. Magn. Magn. Mater. 272-276, e481 (2004). 10.1016/j.jmmm.2003.12.1394
8. M. Rotter, Physica B 345, 231 (2004). 10.1016/j.physb.2003.11.061
9. M. Rotter, Comput. Mater. Sci. 38, 400 (2006). 10.1016/j.commatsci.2006. 03.007
10. J. Jensen and M. Rotter, Phys. Rev. B 77, 134408 (2008). 10.1103/PhysRevB.77.134408
11. S. W. Lovesey, Theory of Neutron Scattering from Condensed Matter (Clarendon, Oxford, 1984).
12. The International Tables for X-ray Crystallography, edited by, T. Hahn, (D. Reidel, Dordrecht, Holland, 1983), Vol. A.
13. G. T. Trammell, Phys. Rev. 92, 1387 (1953). 10.1103/PhysRev.92.1387
14. D. F. Johnston, Proc. Phys. Soc. London 88, 37 (1966). 10.1088/0370-1328/88/1/305
15. S. W. Lovesey, J. Phys. C 2, 470 (1969) 10.1088/0022-3719/2/3/311
16. D. F. Johnston and D. E. Rimmer, J. Phys. C 2, 1151 (1969) 10.1088/0022-3719/2/7/308
17. E. Balcar and S. W. Lovesey, Theory of Magnetic Neutron and Photon Scattering, (Clarendon, Oxford, 1989)
18. C. Stassis and H. W. Deckman, Phys. Rev. B 12, 1885 (1975). 10.1103/PhysRevB.12.1885
19. Note that in Ref. there is a small error in equations (11.141) and (11.142): the imaginary i has been misplaced.
20. N. Kernavanois, Phys. Rev. B 71, 064404 (2005). 10.1103/PhysRevB.71. 064404
21. N. H. van Dijk, Phys. Rev. B 61, 8922 (2000). 10.1103/PhysRevB.61.8922
22. P. Hansmann, Phys. Rev. Lett. 100, 066405 (2008). 10.1103/PhysRevLett. 100.066405
23. Rp =100 hkl | Icalc (hkl) - Iobs (hkl) | hkl | Iobs (hkl) |
24. χ2 = hkl=1 N [Icalc (hkl) - Iobs (hkl)] 2 N σ obs 2 (hkl)
25. A. T. Boothroyd, Phys. Rev. B 60, 1400 (1999). 10.1103/PhysRevB.60.1400
26. A. T. Boothroyd, Phys. Rev. Lett. 78, 130 (1997). 10.1103/PhysRevLett.78. 130
27. P. Allenspach, Z. Phys. B: Condens. Matter 95, 301 (1994). 10.1007/BF01343957
28. L. Soderholm, Phys. Rev. B 43, 7923 (1991). 10.1103/PhysRevB.43.7923
29. H. Drößler, Z. Phys. B: Condens. Matter 100, 1 (1996). 10.1007/s002570050086
30. N. Senthilkumaran, Physica B 223-224, 565 (1996). 10.1016/0921-4526(96) 00175-5
31. V. Nekvasil, J. Magn. Magn. Mater. 226-230, 985 (2001). 10.1016/S0304-8853(00)01168-9
32. A. T. Boothroyd, SPECTRE, a program to calculate the spectra of f electrons in crystal fields in the intermediate coupling approximation (1989-2008).
33. A. T. Boothroyd, Physica C 217, 425 (1993). 10.1016/0921-4534(93)90346-R