Avancerad sökning

Hittade 1 avhandling som matchar ovanstående sökkriterier.

1. 1. Ab initio study of transition metal carbides and actinide compounds

   Författare :Weiwei Sun; Pavel Korzhavyi; Igor Di Marco; Börje Johansson; Leon Petit; KTH; []
   Nyckelord :TEKNIK OCH TEKNOLOGIER; ENGINEERING AND TECHNOLOGY; Computational material science; material physics; Materials Science and Engineering; Teknisk materialvetenskap;

   Sammanfattning : Two classes of materials are investigated using ab intio methods based on density functional theory. The structural properties, electronic structure and thermodynamic properties of binary and ternary transition metal carbides are discussed in details. In addition, two actinide compounds will be presented. LÄS MER