Hi Everyone. As I know, Quantum Espresso can do spin-polarized (nspin = 2 in script) and spin-unpolarized (nspin =1) calculations. But I have a question, that same its mean with spin-unrestricted and spin-restricted wavefunctions?
Thanks. -- Nguyen Van Chuong PhD Student, Department of Physics, Don State Technical University. Rostov on Don, Russia Group Graphene Email: chuongnguyen11 at gmail.com or cpuphys86 at gmail.com Website: http://cpuphys86.webs.com/ Phone mobile: +7 905 45 94 888 -------------- next part -------------- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20140505/badc94ca/attachment.html
