Search found 4 matches
- Sat Feb 26, 2011 1:31 am
- Forum: Ground state
- Topic: How to get m-resolved partial DOS (real spherical harmonics)
- Replies: 2
- Views: 2676
Re: How to get m-resolved partial DOS (real spherical harmon
Anybody can help me? Thanks for your suggestions!
- Sat Feb 26, 2011 1:30 am
- Forum: Ground state
- Topic: How to get m-resolved partial DOS
- Replies: 2
- Views: 3165
Re: How to get m-resolved partial DOS
Anybody can help me? Thanks for your suggestions!
- Thu Jan 13, 2011 1:31 am
- Forum: Ground state
- Topic: How to get m-resolved partial DOS (real spherical harmonics)
- Replies: 2
- Views: 2676
How to get m-resolved partial DOS (real spherical harmonics)
Dear All, I try to get the m-resolved partial DOS using the keywords prtdos=3 and prtdosm=1. But the obtained m-resolved partial DOS is for complex spherical harmonics. How can I get the m-resolved partial DOS for real spherical harmonics? For example, when l=2, how can I get the PDOS for dxy, dxz, ...
- Thu Jan 13, 2011 1:28 am
- Forum: Ground state
- Topic: How to get m-resolved partial DOS
- Replies: 2
- Views: 3165
How to get m-resolved partial DOS
Dear All, I try to get the m-resolved partial DOS using the keywords prtdos=3 and prtdosm=1. But the obtained m-resolved partial DOS is for complex spherical harmonics. How can I get the m-resolved partial DOS for real spherical harmonics? For example, when l=2, how can I get the PDOS for dxy, dxz, ...