A Minimal tight-binding model for ferromagnetic canted bilayer manganites
- Northeastern Univ., Boston, MA (United States); Boston Univ., MA (United States); DOE/OSTI
- Northeastern Univ., Boston, MA (United States)
- Northeastern Univ., Boston, MA (United States); National Univ. of Singapore (Singapore)
- Univ. of Colorado, Boulder, CO (United States)
Half-metallicity in materials has been a subject of extensive research due to its potential for applications in spintronics. Ferromagnetic manganites have been seen as a good candidate and aside from a small minority-spin pocket observed in La2–2xSr1+2xMn2O7 (x = 0.38), transport measurements show that ferromagnetic manganites essentially behave like half metals. Here we develop robust tight-binding models to describe the electronic band structure of the majority as well as minority spin states of ferromagnetic, spin-canted antiferromagnetic and fully antiferromagnetic bilayer manganites. Both the bilayer coupling between the MnO2 planes and the mixing of the |x2 – y2 > and |3z2 – r2 > Mn 3d orbitals play an important role in the subtle behavior of the bilayer splitting. Effects of kz dispersion are included.
- Research Organization:
- Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States). National Energy Research Scientific Computing Center (NERSC) and Advanced Light Source (ALS); Northeastern Univ., Boston, MA (United States); Univ. of Colorado, Boulder, CO (United States)
- Sponsoring Organization:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- Grant/Contract Number:
- AC02-05CH11231; FG02-03ER46066; FG02-07ER46352
- OSTI ID:
- 1624755
- Journal Information:
- Scientific Reports, Journal Name: Scientific Reports Journal Issue: 1 Vol. 4; ISSN 2045-2322
- Publisher:
- Nature Publishing GroupCopyright Statement
- Country of Publication:
- United States
- Language:
- English
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