Abstract
Nuclear resonant scattering of synchrotron radiation was applied to investigate the spin‐crossover complex Fe(tpa)(NCS)2 (tpa=tris(2‐pyridylmethyl)amine). The nuclear forward scattering experiments are compared with conventional Mössbauer experiments, and the nuclear inelastic scattering experiments are compared with the results from a theoretical normal mode analysis based on molecular orbital calculations.
Similar content being viewed by others
References
E. Gerdau and U. van Bürck, in: Resonant Anomalous X-ray Scattering, Theory and Applications, eds. G. Materlik, C.J. Sparks and K. Fischer (Elsevier, New York, 1994) p. 589.
G.V. Smirnov, Hyp. Interact. 97/98 (1996) 551.
J.B. Hastings, D.P. Siddons, U. van Bürck, R. Hollatz and U. Bergmann, Phys. Rev. Lett. 66(6) (1991) 770.
U. van Bürck, D.P. Siddons, J.B. Hastings, U. Bergmann and R. Hollatz, Phys. Rev. B 46 (1992) 6207.
U. Bergmann, D.S. Shastri, D.P. Siddons, B.W. Batterman and J.B. Hastings, Phys. Rev. B 50(9) (1994) 5957.
M. Seto, Y. Yoda, S. Kikuta, X.W. Zhang and M. Ando, Phys. Rev. Lett. 74 (1995) 3828.
W. Sturhahn, T.S. Toellner, E.E. Alp, X.W. Zhang, M. Ando, Y. Yoda, S. Kikuta, M. Seto, C.W. Kimball and B. Dabrovsky, Phys. Rev. Lett. 74 (1995) 3832.
A.I. Chumakov, R. Rüffer, A.Q.R. Baron, H. Grünsteudel and H.F. Grünsteudel, Phys. Rev. B 54 (1996) 9596.
P. Gütlich, A. Hauser and H. Spiering, Angew. Chemie 106 (1994) 2109; see also Angew. Chemie Int. Ed. Engl. 33 (1994) 2024.
E. König, Struct. Bond. 76 (1991) 51.
H. Toftlund, Coord. Chem. Rev. 94 (1989) 67.
J.K. Beattie, Adv. Inorg. Chem. 32 (1988) 1.
P. Gütlich, Struct. Bond. 44 (1981) 83.
H. Goodwin, Coord. Chem. Rev. 18 (1976) 293.
R. Rüffer and A.I. Chumakov, Hyp. Interact. 97/98 (1996) 589.
W. Sturhahn and E. Gerdau, Phys. Rev. B 49 (1994) 9285.
A.D. Becke, J. Chem. Phys. 98 (1993) 5648.
C. Lee, W. Yang and R.G. Parr, Phys. Rev. B 37 (1988) 785.
M.J. Frisch et al., in: Gaussian '94, Revision C.3 (Gaussian Inc., Pittsburgh, PA, 1995).
M.W. Wong, Chem. Phys. Lett. 256 (1996) 391.
B. Gallois, J.-A. Real, C. Hauw and J. Zarembowitch, Inorg. Chem. 29 (1990) 1152.
M. Meyer-Klaucke, H. Paulsen, M. Gerdau, S. Schwendy, H. Winkler, A.X. Trautwein, H.F. Nolting and H. Toftlund, in: Conference Proceedings ICBIC 8, Yokohama, Japan (1997).
H. Paulsen, M. Grodzicki, H. Winkler and A.X. Trautwein, Chem. Phys. Lett., submitted.
Rights and permissions
About this article
Cite this article
Grünsteudel, H., Paulsen, H., Meyer‐Klaucke, W. et al. Nuclear resonant scattering and molecular orbital calculations on an iron(II) spin‐crossover complex. Hyperfine Interactions 113, 311–317 (1998). https://doi.org/10.1023/A:1012641614937
Issue Date:
DOI: https://doi.org/10.1023/A:1012641614937