| Autor: |
Larsson, T., Noläng, B., Andersson, Y. |
| Zdroj: |
Journal of Alloys and Compounds; December 1995, Vol. 231 Issue: 1-2 p153-158, 6p |
| Abstrakt: |
Band structure calculations have been performed on Ti3P, Ti3PH0.5and Ti3PH using the linear muffin tin orbital method. Hydrogen occupies two different positions in the crystal structure. The results show that one of the positions is more favourable than the other. Chemical bonding and stability are related to the densities of states and the total electronic energies. |
| Databáze: |
Supplemental Index |
| Externí odkaz: |
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