Multiscale simulations in simple metals: A density-functional-based methodology

Choly, NicholasLu, GangWeinan, E.Kaxiras, Efthimios2019-09-202005Choly, Nicholas, Gang Lu, Weinan E, and Efthimios Kaxiras. 2005. “Multiscale Simulations in Simple Metals: A Density-Functional-Based Methodology.” Physical Review B 71 (9). https://doi.org/10.1103/physrevb.71.094101.1098-01211550-235Xhttp://nrs.harvard.edu/urn-3:HUL.InstRepos:41384087en-USMultiscale simulations in simple metals: A density-functional-based methodologyJournal Article2019-09-2010.1103/PhysRevB.71.094101