Publication Date:
2013-08-10
Description:
Author(s): Youqi Ke, Florian Libisch, Junchao Xia, Lin-Wang Wang, and Emily A. Carter Orbital-free (OF) density functional theory (DFT) directly solves for the electron density rather than the wave function of many electron systems, greatly simplifying and enabling large scale first principles simulations. However, the required approximate noninteracting kinetic energy density functi... [Phys. Rev. Lett. 111, 066402] Published Fri Aug 09, 2013
Keywords:
Condensed Matter: Electronic Properties, etc.
Print ISSN:
0031-9007
Electronic ISSN:
1079-7114
Topics:
Physics
Permalink