In order to use this pseudopotential with LDA+U not only should 
set_hubbard_l.f90 & tabd.f90 be modified in versions 4.3 to include Pt etc.; 
one must also modify the *.UPF file itself and change the element name from 
"pt" to "Pt" in the header.  Thanks.  

Yours &c.

Jonny


Reply via email to