[Wien] Would PDOS always align with the one shown in TDOS?

段鹤 duanhe at mail.sitp.ac.cn
Fri Aug 25 03:11:35 CEST 2006


Dear wien2k users and developers,
	I calculated the total density of states (TDOS)of CdTe following the 
instructions in the userguide,then I checked the lm-like partial density of 
states (PDOS) for Cd and Te atoms, but the conduction band edge of the PDOS 
is not always align with the one shown in the TDOS. How to explain it? 

With best regards, 

He Duan, PhD
Room 24309, National Laboratory for Infrared Physics
Institute of Technical Physics
Chinese Academy of Sciences
500 Yutian Road
Shanghai, 200083, China
E-mail: duanhe at mail.sitp.ac.cn, duanhe_xju at yahoo.com.cn
Tel: +86(0)21 65420850 ext.24309


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