Abstract
|
|
---|---|
Pb17Li is today a reference breeder material in diverse fusion R&D programs worldwide. Extracting dynamic and structural properties of liquid LiPb mixtures via molecular dynamics simulations, represent a crucial step for multiscale modeling efforts in order to understand the suitability of this compound for future Nuclear Fusion technologies. At present a Li-Pb cross potential is not available in the literature. Here we present our first results on the validation of two semi-empirical potentials for Li and Pb in liquid phase. Our results represent the establishment of a solid base as a previous but crucial step to implement a LiPb cross potential. Structural and thermodynamical analyses confirm that the implemented potentials for Li and Pb are realistic to simulate both elements in the liquid phase. | |
International
|
Si |
JCR
|
Si |
Title
|
Fusion Science and Technology |
ISBN
|
1536-1055 |
Impact factor JCR
|
0 |
Impact info
|
|
Volume
|
61 |
|
|
Journal number
|
1 |
From page
|
77 |
To page
|
82 |
Month
|
SIN MES |
Ranking
|