Structural and electronic properties of perovskite hydrides ACaH3 (A=Cs and Rb)
We have performed structural properties, electronic properties, charge density and potential distribution of CsCaH3 and RbCaH3 using TB-LMTO-ASA approach under local density approximation. Our findings show that both CsCaH3 and RbCaH3 are non-magnetic and then insulators with estimated direct band...
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| Hauptverfasser: | , , , |
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| Format: | Artigo |
| Sprache: | Inglês |
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Department of Physics, Mahendra Morang Adarsh Multiple Campus, Tribhuvan University
2015-12-01
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| Schriftenreihe: | Bibechana |
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| Online-Zugang: | https://nepjol.info/index.php/BIBECHANA/article/view/13437 |
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