change the format statements in electrons (label 9060 and the like) and converge energy accordingly. however ... why do you need more than 10 digits ?
stefano On 04/12/2011 08:43 AM, Shyam Khambholja wrote: > Dear all, > > I want to calculate total energy of compounds with accuarcy upto tenth digit > after decimal point. what should I need to edit ? > > with thanks, > > > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://www.democritos.it/mailman/listinfo/pw_forum -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20110412/7a1df8b3/attachment.htm
