Thank you very much! This option has been included in the fdf file, but I don,t know exactly how to calculate from the last SCF step after killing the running because I need to revice the fdf file options, for example, Meshcutoff value. 1, killing the running 2, amend a new option to the fdf file 3, siesta <a.fdf|tee a.out directly, am I right? thanks again!!
2007/3/29, bipul rakshit <[EMAIL PROTECTED]>:
use the following option *UseSaveData .true.* *it reads every necessary thing from the previous run* *Wang kunpeng <[EMAIL PROTECTED]>* wrote: Hi all, Is there anybody who knows how to exactly restart a SIESTA calculation? Thank you very much! Best regards, k.p.wang uni-osnabrueck ------------------------------ Here's a new way to find what you're looking for - Yahoo! Answers<http://us.rd.yahoo.com/mail/in/yanswers/*http://in.answers.yahoo.com/>
