[Wien] [WIEN]Maybe It is a Mini-Bug in Joint
Jun Jiang
czjiangjun at gmail.com
Sat Nov 18 13:51:08 CET 2006
Dear Professor Blaha:
In SRC_joint/noculc.f line 148,It reads that
DOS2=(E-E3)*DOS1
however, in line154-155 the term F2 is expressed as below:
F2=(FAC(NF,4)-FAC(NF,1))/E41+(FAC(NF,4)-FAC(NF,2))/E42 &
+(FAC(NF,4)-FAC(NF,3))/E43
After I have checked this reference,
G. Lehmann and M. Taut, Phys. Status Solidi B 54, 469 (1972)
I believe DOS2 should be modified like this
DOS2=(E3-E)*DOS1
Best Regards!
Yours
sincerely Jun Jiang
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