Density functional self-consistent quantum mechanics/molecular mechanics theory for linear and nonlinear molecular properties: Applications to solvated water and formaldehyde

Christian Benedikt Nielsen, Ove Christiansen, Kurt Valentin Mikkelsen, Jacob Kongsted

130 Citations (Scopus)
Original languageEnglish
JournalJournal of Chemical Physics
Volume126
Issue number15
Pages (from-to)154112
ISSN0021-9606
Publication statusPublished - 2007

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