Pure Appl. Chem., 2008, Vol. 80, No. 6, pp. 1211-1227
http://dx.doi.org/10.1351/pac200880061211
Experimentally consistent atomistic modeling of bulk and local structure in liquids and disordered materials by empirical potential structure refinement
References
- 1. E. Buncel, R. Stairs, H. Wilson. The Role of the Solvent in Chemical Reactions, Oxford University Press, Oxford (2003).
- 2. A. J. Ikushima, T. Fujiwara, K. Saito. Appl. Phys. Rev. 88, 1201 (2000). (http://dx.doi.org/10.1063/1.373805)
- 3. N. E. Cusack. The Physics of Structurally Disordered Matter, Adam Hilger, Bristol (1987).
- 4. R. L. McGreevy. J. Phys. Condens. Matter 13, R877 (2001). (http://dx.doi.org/10.1088/0953-8984/13/46/201)
- 5. A. K. Soper. Chem. Phys. 202, 298 (1996). (http://dx.doi.org/10.1016/0301-0104(95)00357-6)
- 6. A. K. Soper. Phys. Rev. B 72, 104204 (2005). (http://dx.doi.org/10.1103/PhysRevB.72.104204)
- 7. M. P. Allen, D. J. Tildesley. Computer Simulation of Liquids, Clarendon Press, Oxford (1987).
- 8. A. K. Soper. Mol. Phys. 99, 1503 (2001). (http://dx.doi.org/10.1080/00268970110056889)
- 9. A. K. Soper, W. S. Howells, A. C. Hannon. ATLAS - Analysis of Time-of-Flight Diffraction Data from Liquid and Amorphous Samples; Rutherford Appleton Laboratory Report, RAL 89-046 (1989).
- 10. J. E. Enderby, D. M. North, P. A. Egelstaff. Philos. Mag. 14, 961 (1966). (http://dx.doi.org/10.1080/14786436608244767)
- 11. J. L. Finney, A. K. Soper. Chem. Soc. Rev. 23, 1 (1994). (http://dx.doi.org/10.1039/cs9942300001)
- 12. B. E. Warren. X-ray Diffraction, Dover, New York (1990).
- 13. A. Filipponi, A. Di Cicco, C. R. Natoli. Phys. Rev. B 52, 15122 (1995). (http://dx.doi.org/10.1103/PhysRevB.52.15122)
- 14. A. Filipponi. J. Phys. Condens. Matter 6, 8415 (1994). (http://dx.doi.org/10.1088/0953-8984/6/41/006)
- 15. A. Filipponi. J. Phys. Condens. Matter 13, R23 (2001). (http://dx.doi.org/10.1088/0953-8984/13/7/201)
- 16. G. Ferlat, J.-C. Soetens, A. San Miguel, P. A. Bopp. J. Phys. Condens. Matter 17, S145 (2005). (http://dx.doi.org/10.1088/0953-8984/17/5/015)
- 17. A. L. Ankudinov, B. Ravel, J. J. Rehr, S. D. Conradson. Phys. Rev. B 58, 7565 (1998). (http://dx.doi.org/10.1103/PhysRevB.58.7565)
- 18. A. H. Narten. J. Chem. Phys. 56, 1185 (1972). (http://dx.doi.org/10.1063/1.1677342)
- 19. L. Comez, A. Di Cicco, J.-P. Itie, A. Polian. Phys. Rev. B 65, 014114 (2001). (http://dx.doi.org/10.1103/PhysRevB.65.014114)
- 20. R. L. Mozzi, B. E. Warren. J. Appl. Crystallogr. 2, 164 (1969). (http://dx.doi.org/10.1107/S0021889869006868)
- 21. G. N. Greaves, A. Fontaine, P. Lagarde, D. Raoux, S. J. Gurman. Nature 293, 611 (1981). (http://dx.doi.org/10.1038/293611a0)
- 22. J. Stohr, L. Johansson, I. Lindau, P. Pianetta. Phys. Rev. B 20, 664 (1979). (http://dx.doi.org/10.1103/PhysRevB.20.664)
- 23. D. T. Bowron, S. Diaz-Moreno. J. Phys. Chem. B 111, 11397 (2007).
- 24. A. K. Soper. Chem. Phys. 258, 121 (2000). (http://dx.doi.org/10.1016/S0301-0104(00)00179-8)
- 25. S. Diaz-Moreno, A. Munoz-Paez, J. Chaboy. J. Phys. Chem. A 104, 1278 (2000). (http://dx.doi.org/10.1021/jp9928255)
- 26. H. J. C. Berendsen, J. R. Grigera, T. P. Straatsma. J. Phys. Chem. 91, 6269 (1987). (http://dx.doi.org/10.1021/j100308a038)
- 27. T. Ikeda, M. Hirata, T. Kimura. J. Chem. Phys. 122, 024510 (2005). (http://dx.doi.org/10.1063/1.1832594)
- 28. P. H. Fuoss, P. Eisenberger, W. K. Warburton, A. Bienenstock. Phys. Rev. Lett. 46, 1537 (1981). (http://dx.doi.org/10.1103/PhysRevLett.46.1537)
- 29. S. Ramos. "Resonant X-ray Scattering Studies of Concentrated Aqueous Solutions", Ph.D. thesis, University of Bristol, UK (2001).