Title of article :
Multi-scale modelling of materials for fusion power plants
Author/Authors :
Nguyen-Manh، نويسنده , , D. and Dudarev، نويسنده , , S.L.، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2006
Pages :
5
From page :
112
To page :
116
Abstract :
Body-centred cubic (bcc) transition metal-based alloys are prime candidate materials for structural components of future fusion power plants. The development of a reliable hierarchy of models describing materials under neutron irradiation is an issue of significant importance for the international fusion programme. In this paper, a multi-scale modelling approach is proposed for studying mechanical properties of these types of materials. A specific focus on establishing genetic methods for generating quantum mechanically-based potentials usable for defect modelling in bcc metals, alloys and magnetic materials is presented.
Keywords :
multi-scale modelling , Fusion materials , Interstitial defects , bcc transition metals , Frenkel–Kontorova model , Tight-binding scheme , Interatomic potentials
Journal title :
Computational Materials Science
Serial Year :
2006
Journal title :
Computational Materials Science
Record number :
1681529
Link To Document :
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