Hi, CCLer I am interesting in find out what is the largest system studied using DFT method until now. In another words, assuming one has enomous of CPU power to himself (eg. 512 cpu, 512GB memory, no limit cpu time), what is the largest system has been optimized?
The issue might be, what is the largest system where a geometry optimization makes sense. +---------------------------------+----------------------------------+ | Prof. Christoph van Wüllen | Tele-Phone (+49) (0)30 314 27870 | | Technische Universität Sekr. C3 | Tele-Fax (+49) (0)30 314 23727 | | Straße des 17. Juni 135 | eMail | | D-10623 Berlin, Germany | Christoph.vanWullen;at;TU-Berlin.De | +---------------------------------+----------------------------------+ --