Skip to Content.
Sympa Menu

forum - the different highest angular momentum between pdos calculation and .psp file

forum@abinit.org

Subject: The ABINIT Users Mailing List ( CLOSED )

List archive

the different highest angular momentum between pdos calculation and .psp file


Chronological Thread 
  • From: shinekin <shinekin@hotmail.com>
  • To: "forum@abinit.org" <forum@abinit.org>
  • Subject: the different highest angular momentum between pdos calculation and .psp file
  • Date: Sat, 21 Jul 2007 16:31:50 +0800
  • Importance: Normal

Dear abinit users,
 
After i run the pdos calculation, i got 5 differents angular momentum datas,from l=0 to 4. but from the .psp file of the element i
 
calculated ,i know that the lmax=3, Does it means that the datas i needed are just s,p,d,f ? Why the g angular momentum were
 
generated by the abinit since there is no defination about l=4 in the .psp file?
 
Thanks in advance!
 
   Regards
 
Shinekin


探索 Windows Vista 的世界 了解更多信息!


Archive powered by MHonArc 2.6.16.

Top of Page