Dear all I compute imaginary part of dielectric function for (h-BN) and i get this result but there is some remarkable difference between my result and reported one. Where is my problem? (SCF, NSCF, result and reported dielectric funtion (Ref: Camputatioal Materials Science 22 (2001) 78-80) are attached). I used the SCF and NSCF input file from test3 of WANT package. Thanks a lot Mohsen Modarsei M.Sc Student of Solid State Physics, Ferdowsi University of Mashhad, Iran. -------------- next part -------------- A non-text attachment was scrubbed... Name: BNHscf.in Type: application/octet-stream Size: 3188 bytes Desc: not available Url : http://www.democritos.it/pipermail/pw_forum/attachments/20100528/88a3f35a/attachment-0002.obj -------------- next part -------------- A non-text attachment was scrubbed... Name: BNHnscf.in Type: application/octet-stream Size: 3190 bytes Desc: not available Url : http://www.democritos.it/pipermail/pw_forum/attachments/20100528/88a3f35a/attachment-0003.obj -------------- next part -------------- A non-text attachment was scrubbed... Name: Result.jpg Type: image/jpeg Size: 34606 bytes Desc: not available Url : http://www.democritos.it/pipermail/pw_forum/attachments/20100528/88a3f35a/attachment-0001.jpg -------------- next part -------------- A non-text attachment was scrubbed... Name: reported..JPG Type: image/jpeg Size: 23266 bytes Desc: not available Url : http://www.democritos.it/pipermail/pw_forum/attachments/20100528/88a3f35a/attachment-0001.jpeg
