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From density functional theory to defect level in silicon: Does the “band gap problem” matter?

By Peter A. Schultz

Multiscale Dynamic Materials Modeling, Sandia National Laboratories, Albuquerque, NM, a resource for nanoscience and nanotechnology, is supported by the National Science Foundation and other funding agencies. Any opinions, findings, and conclusions or recommendations expressed in this material are those of the author(s) and do not necessarily reflect the views of the National Science Foundation.