[20a-H113-1~12] 15.8 Crystal evaluation, impurities and crystal defects

[20a-H113-7] The Hakoniwa method, an approach to predict material properties based on statistical thermodynamics and ab initio calculations

Eiji Kamiyama^1,2, 〇Kouji Sueoka¹ (1.Okayama Pref. Univ., 2.Globalwafers Japan)

Keywords:ab initio calculations,statistical thermodynamics,impurity