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The electronic structure of the hydrogen solid solution in Ti3P
Uppsala University.
Uppsala University.
Uppsala University.
1995 (English)In: JOURNAL OF ALLOYS AND COMPOUNDS, Vol. 231, no 1-2, 153-158 p.Other (Other scientific)
Abstract [en]

Band structure calculations have been performed on Ti3P, Ti3PH0.5 and 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

Place, publisher, year, edition, pages
ELSEVIER SCIENCE SA LAUSANNE , 1995. Vol. 231, no 1-2, 153-158 p.
Keyword [en]
metal hydride; band structure; chemical bonding; ABSORPTION
URN: urn:nbn:se:uu:diva-70053OAI: oai:DiVA.org:uu-70053DiVA: diva2:97964
Addresses: Larsson T, UNIV UPPSALA, DEPT INORGAN CHEM, S-75121 UPPSALA, SWEDEN.Available from: 2008-10-17 Created: 2008-10-17

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