CASTEP is a software package which USES density functional theory to provide a good atomic-level descriptionof all manner of materials and molecules.
CASTEP是使用密度的一个软件包裹提供对各种各样的材料和分子的好原子水平的描述的功能的理论。
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The loci and the effective curves of the criterion are of nonlinear types that could give a better description to the yield characteristics ofmaterials.