In data 14 agosto 2009 alle ore 10:44:40, Nguyen Thanh Cuong <ntcuong at jaist.ac.jp> ha scritto: > Does anyone have generated the paw pseudo-potentials for Al and Ni with > ld1 code? Would you share the ld1 input files?
Dear Nguyen, I'm sending you an input file for Aluminium, it is not very tested it (I've only checked basic Al structure and 2 AlN structures). I don't have one for Ni, but I think it could be adapted from a Palladium input you can find in atomic_doc/paw_library/input good luck! -- Lorenzo Paulatto SISSA & DEMOCRITOS (Trieste) phone: +39 040 3787 511 skype: paulatz www: http://people.sissa.it/~paulatto/ *** save italian brains *** http://saveitalianbrains.wordpress.com/ -------------- next part -------------- A non-text attachment was scrubbed... Name: Al.in Type: application/octet-stream Size: 746 bytes Desc: not available Url : http://www.democritos.it/pipermail/pw_forum/attachments/20090817/88a95320/attachment.obj
