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- From: zfhou@mail.edu.cn
- To: forum@abinit.org
- Subject: How to set momentum-dependent pseudopotential
- Date: Wed, 27 Apr 2005 10:01:44 +0200
When sovling Kohn-Sham equation by plane-wave pseudopotential method , we
deal different valence pseudowave of momentum l=0,1,2... with different
non-local l-dependent pseudopotential. Thus is illustrated in 220-221, Part
III, <<Electronic Structure>>(by Richard M.Martin).
But how could I set this maximum l in ABINIT. For example, I just want to
calculate Si by using only l=0 pseudopotential as total valence
pseudopotential . Does this maximun l exist in the produced pseudopotential
or in ABINIT code?
- How to set momentum-dependent pseudopotential, zfhou, 04/27/2005
- Re: [abinit-forum] How to set momentum-dependent pseudopotential, verstraete, 04/27/2005
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