Dear Guido, Thanks for your help. Btw, are you aware of the average.x problem? I did the calculation as the examples (PP/examples/WorkFct_example & dipole_example) said, but don't know why it doesn't work. Thank you again!
Cheers, Jin --- *Jin Chang* | School of Chemistry, Physics & Mechanical Engineering | Queensland University of Technology | GPO Box 2434 | Brisbane QLD 4001 | AUSTRALIA | CRICOS No. 00213J | Phone: +61 0430244227 | Email: jin.chang at student.qut.edu.au<https://outlook.qut.edu.au/OWA/redir.aspx?C=dd0074882fd549aba790b5f9eda2cdfb&URL=mailto%3ajin.chang%40student.qut.edu.au> -------------- next part -------------- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20121012/be12a759/attachment.html
