Importance of thermal disorder and electronic occupation for temperature dependence of optical conductivity in FeSi and MnSi

作者: T. Jarlborg

DOI: 10.1103/PHYSREVB.76.205105

关键词:

摘要: The spectral weight (SW) for optical transitions in FeSi and MnSi are calculated as a function of temperature by means linear muffin-tin orbital--local density approximation band calculations. main effects, caused structural disorder electronic Fermi-Dirac distribution, act oppositely on the $T$ dependence SW, while variation magnetic moment has only minor effect. calculations agree with experimental findings an increasing SW decreasing $T$. results can be understood from change structure disorder.

参考文章(24)
V. Jaccarino, G. K. Wertheim, J. H. Wernick, L. R. Walker, Sigurds Arajs, Paramagnetic Excited State of FeSi Physical Review. ,vol. 160, pp. 476- 482 ,(1967) , 10.1103/PHYSREV.160.476
L. F. Mattheiss, D. R. Hamann, Band structure and semiconducting properties of FeSi. Physical Review B. ,vol. 47, pp. 13114- 13119 ,(1993) , 10.1103/PHYSREVB.47.13114
G.E. Grechnev, T. Jarlborg, A.S. Panfilov, M. Peter, I.V. Svechkarev, The effect of pressure on the electronic structure and magnetic susceptibility of ε-FeSi Solid State Communications. ,vol. 91, pp. 835- 838 ,(1994) , 10.1016/0038-1098(94)90659-9
Castor Fu, M. P. C. M. Krijn, S. Doniach, Electronic structure and optical properties of FeSi, a strongly correlated insulator Physical Review B. ,vol. 49, pp. 2219- 2222 ,(1994) , 10.1103/PHYSREVB.49.2219
V. I. Anisimov, S. Yu Ezhov, I. S. Elfimov, I. V. Solovyev, T. M. Rice, Singlet semiconductor to ferromagnetic metal transition in FeSi. Physical Review Letters. ,vol. 76, pp. 1735- 1738 ,(1996) , 10.1103/PHYSREVLETT.76.1735
T. Jarlborg, ϵ-FeSi: a material sensitive to thermal disorder Physics Letters A. ,vol. 236, pp. 143- 147 ,(1997) , 10.1016/S0375-9601(97)00726-3
P. Pedrazzini, H. Wilhelm, D. Jaccard, T. Jarlborg, M. Schmidt, M. Hanfland, L. Akselrud, H. Q. Yuan, U. Schwarz, Yu. Grin, F. Steglich, Metallic state in cubic FeGe beyond its quantum phase transition. Physical Review Letters. ,vol. 98, pp. 047204- ,(2007) , 10.1103/PHYSREVLETT.98.047204
C. Pfleiderer, G. J. McMullan, S. R. Julian, G. G. Lonzarich, Magnetic quantum phase transition in MnSi under hydrostatic pressure Physical Review B. ,vol. 55, pp. 8330- 8338 ,(1997) , 10.1103/PHYSREVB.55.8330
M. Corti, F. Carbone, M. Filibian, Th. Jarlborg, A. A. Nugroho, P. Carretta, Spin dynamics in a weakly itinerant magnet from Si 29 NMR in MnSi Physical Review B. ,vol. 75, pp. 115111- ,(2007) , 10.1103/PHYSREVB.75.115111