On Tuesday, August 26, 2008 at 10:22, wangqj1 at 126.com wrote: > > Dear all > When I plot the 2D charge density of ZnO (1 0 0) with > pp.x,but I don't know how to set the parameter of the vectors : > e1(1) =?, e1(2)=? e1(3) = ?, > e2(1) =?, e2(2)=?, e2(3) = ?, > Could somebody who know it tell me the answer?
They're two span vectors of your plane on which you want to present the 2D charge density, this job can use the pwgui to accomplish, it is very convenient and also have some descriptions of the span vectors you mentioned above in the pwgui's help. Sincerely yours, -- Hongsheng Zhao <zhaohscas at yahoo.com.cn> Xinjiang Technical Institute of Physics and Chemistry Chinese Academy of Sciences GnuPG DSA: 0xD108493 2008-8-26 __________________________________________________ ??????????????? http://cn.mail.yahoo.com
