期刊
JOURNAL OF ALLOYS AND COMPOUNDS
卷 477, 期 1-2, 页码 L11-L12出版社
ELSEVIER SCIENCE SA
DOI: 10.1016/j.jallcom.2008.10.025
关键词
Hydrogen storage materials; Intermetallics; Thermal analysis
资金
- EU
- Netherlands Organization for Scientific Research (NWO)
In this letter we address the discrepancy in the literature concerning the enthalpy of formation of AlB(2) by means of density functional calculations. The literature values vary from 23 to 151 kJ/mol. Our calculated value of 16 kJ/mol clearly favors the lower value with which it is in agreement within the expected accuracy of DFT. (C) 2008 Elsevier B.V. All rights reserved.
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