Hybridization Gap and Dresselhaus Spin Splitting in EuIr4In2Ge4

被引:8
作者
Calta, Nicholas P. [1 ]
Im, Jino [2 ]
Rodriguez, Alexandra P. [1 ]
Fang, Lei [1 ,3 ]
Bugaris, Daniel E. [3 ]
Chasapis, Thomas C. [1 ]
Freeman, Arthur J. [2 ]
Kanatzidis, Mercouri G. [1 ,3 ]
机构
[1] Northwestern Univ, Dept Chem, Evanston, IL 60208 USA
[2] Northwestern Univ, Dept Phys, Evanston, IL 60208 USA
[3] Argonne Natl Lab, Div Mat Sci, Argonne, IL 60439 USA
关键词
crystal growth; electronic structure; hybridization; intermetallic phases; X-ray diffraction; HALL-COEFFICIENT; PLANE;
D O I
10.1002/anie.201504315
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
EuIr4In2Ge4 is a new intermetallic semiconductor that adopts a non-centrosymmetric structure in the tetragonal I (4) over bar 2m space group with unit cell parameters a=6.9016(5)angstrom and c=8.7153(9)angstrom. The compound features an indirect optical band gap E-g=0.26(2)eV, and electronic-structure calculations show that the energy gap originates primarily from hybridization of the Ir 5d orbitals, with small contributions from the Ge 4p and In 5p orbitals. The strong spin-orbit coupling arising from the Ir atoms, and the lack of inversion symmetry leads to significant spin splitting, which is described by the Dresselhaus term, at both the conduction- and valence-band edges. The magnetic Eu2+ ions present in the structure, which do not play a role in gap formation, order antiferromagnetically at 2.5K.
引用
收藏
页码:9186 / +
页数:6
相关论文
共 36 条
[1]   EXTENSION OF AUKERMAN-WILLARDSON 2-BAND HALL COEFFICIENT ANALYSIS [J].
ALLGAIER, RS .
JOURNAL OF APPLIED PHYSICS, 1965, 36 (08) :2429-&
[2]  
[Anonymous], 2006, X AREA VERS 1 39
[3]   HIGH-TEMPERATURE HALL COEFFICIENT IN GAS [J].
AUKERMAN, LW ;
WILLARDSON, RK .
JOURNAL OF APPLIED PHYSICS, 1960, 31 (05) :939-940
[4]   PROJECTOR AUGMENTED-WAVE METHOD [J].
BLOCHL, PE .
PHYSICAL REVIEW B, 1994, 50 (24) :17953-17979
[5]  
Chadov S, 2010, NAT MATER, V9, P541, DOI [10.1038/NMAT2770, 10.1038/nmat2770]
[6]   THEORY OF IMPURITY SCATTERING IN SEMICONDUCTORS [J].
CONWELL, E ;
WEISSKOPF, VF .
PHYSICAL REVIEW, 1950, 77 (03) :388-390
[7]   SPIN-ORBIT COUPLING EFFECTS IN ZINC BLENDE STRUCTURES [J].
DRESSELHAUS, G .
PHYSICAL REVIEW, 1955, 100 (02) :580-586
[8]  
Dresselhaus M. S., 2007, Group Theory: Application to the Physics of Condensed Matter
[9]   Thermoelectric properties of the Kondo insulator FeSb2 [J].
Figueira, M. S. ;
Silva-Valencia, J. ;
Franco, R. .
EUROPEAN PHYSICAL JOURNAL B, 2012, 85 (06)
[10]   Electronic correlations in FeGa3 and the effect of hole doping on its magnetic properties [J].
Gamza, M. B. ;
Tomczak, J. M. ;
Brown, C. ;
Puri, A. ;
Kotliar, G. ;
Aronson, M. C. .
PHYSICAL REVIEW B, 2014, 89 (19)