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by zhangting
Tue Aug 31, 2010 8:50 am
Forum: Ground state
Topic: prtdos=3 error
Replies: 2
Views: 3041

prtdos=3 error

Dear all: I'm calculating DOS of metal atoms attached on graphene system. While my calculation encounter with such error: ================================ ioarr: writing density data ioarr: file name is DOS_1_pdoso_DEN ioarr: data written to disk file DOS_1_pdoso_DEN partial_dos_fractions : spaceCom...