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RE: [abinit-forum] Integrated density of states


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  • From: verstraete@pcpm.ucl.ac.be
  • To: "'forum@abinit.org'" <forum@abinit.org>
  • Subject: RE: [abinit-forum] Integrated density of states
  • Date: Fri, 4 Apr 2003 17:17:51 +0200 (CEST)

Actually it's not a waste of space: there is an analytical version of the
integrated DOS which is much more precise, eg. to get the Fermi level. And
to boot it doesn't take much time. All this is implemented with the
improved Blochl version, and Xavier has it. Should be in the next abinit.

M.

--
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Matthieu Verstraete mailto:verstraete@pcpm.ucl.ac.be
PCPM, Boltzmann, pl. Croix du Sud, 1 tel: 010/ 47 86 81
B-1348 Louvain-la-Neuve Belgium fax: 010/ 47 34 52




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