Dear all
In the description of projwfc.x, it is announced that orthogonalized atomic
wavefunctions were used in the PDOS calculation, and each orbit is labeled with
an angular number. Does this mean these wavefunctions still have definite
angular numbers once they are linear combined from the atomic orbits which are
already eignvalues of angular operator? It seems impossible if they are defined
as (3.200) in the book of "Modern quantum chemistry".Is there any
misunderstanding of me?
------------------
庞瑞(PANG Rui)
South University of Science and Technology of China/Department of Physics
No.1088,Xueyuan Road, Shenzhen,Guangdong
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