DFTB3: Extension of the Self-Consistent-Charge Density-Functional Tight-Binding Method (SCC-DFTB)

TitleDFTB3: Extension of the Self-Consistent-Charge Density-Functional Tight-Binding Method (SCC-DFTB)
Publication TypeJournal Article
Year of Publication2011
AuthorsGaus, M, Cui, Q, Elstner, M
JournalJournal of Chemical Theory and Computation
Volume7
Pagination931-948
Date PublishedApr
ISBN Number1549-9618
Accession NumberWOS:000289315700017