Sahoo, S K (2014) A comparative study of the electronic properties of perovskite hydrides of type ABH3. MSc thesis.
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Abstract
The electronic properties of some Perovskite hydrides; LiMgH_3,KMgH_(3,) LiCaH_3 are studied using the Tight Binding Approximation included in the TB-LMTO program. The band structures and density of states are calculated. From the density of states calculation we found out the band gap. Also from the Fermi energy level we interpreted whether the compound has metallic behavior or not. Finally,a comparative study of their electronic properties is carried out.
| Item Type: | Thesis ( MSc) |
|---|---|
| Uncontrolled Keywords: | Tight Binding Method; Linear Muffin-Tin Potential; Perovskite hydrides;Band structure; Density of states; Space group; Lattice constant |
| Subjects: | Physics > Astronomy and Astrophysics |
| Divisions: | Sciences > Department of Physics |
| ID Code: | 5507 |
| Deposited By: | Hemanta Biswal |
| Deposited On: | 18 Jul 2014 14:52 |
| Last Modified: | 18 Jul 2014 14:52 |
| Supervisor(s): | Ganguli, B |
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