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The behaviour of hydrogen, nitrogen and oxygen impurities in boron carbide and aluminium dodecaboride

✍ Scribed by P.D. Kervalishvili; K.A. Giorgadze; M.L. Tabutsidze


Publisher
Elsevier Science
Year
1991
Tongue
English
Weight
223 KB
Volume
5
Category
Article
ISSN
0925-4005

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## Abstract A theoretical approach to the study of both, the energy of a hydrogen impurity in a metal and the metal‐hydrogen impurity interaction is described. The analysis involves the virial and Hellmann Feynman theorems and the Kohn‐Sham formalism. Detailed calculations are performed for the cas