[Pw_forum] Why uspp Hf has the p state weights in pdos analysis?
zhaohscas at yahoo.com.cn
Tue Aug 26 13:17:02 CEST 2008
I use the Hf 5d2 6s2 in the uspp scheme for my research, in the pdos analysis of my results, I can also find the Hf's p state weights in pdos analysis. Why does this happen?
PS The attachment is the snapshot of the p state of Hf.
Hongsheng Zhao <zhaohscas at yahoo.com.cn>
Xinjiang Technical Institute of Physics and Chemistry
Chinese Academy of Sciences
GnuPG DSA: 0xD108493
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