Sarma, DD and Shanthi, N and Mahadevan, Priya (1994) Electronic structure of 3d transition metal perovskites, $LaMO_3$ from band structure calculations. In: Physica C:Superconductivity, 235-24 (3). pp. 2115-2116.
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We have performed band structure calculations for $LaMO_3$ with M=Ti-Ni within the linearized muffin-tin orbital (LMTO) method using the atomic sphere approximation (ASA). We have estimated the charge transfer excitation energy (\Delta) and the hopping interaction strengths (t) by fitting LMTO-ASA results with that from a parametrized tight binding (TB) approach and compared the results with experiments.
|Item Type:||Journal Article|
|Additional Information:||Copyright of this article belongs to Elsevier.|
|Department/Centre:||Division of Chemical Sciences > Solid State & Structural Chemistry Unit
Division of Physical & Mathematical Sciences > Physics
|Date Deposited:||13 Aug 2007|
|Last Modified:||19 Sep 2010 04:38|
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