Quantum Calculations in Solution of Energies, Structures, and Properties with a Domain Decomposition Polarizable Continuum Model

Nottoli, Michele (Corresponding author); Stamm, Benjamin; Scalmani, Giovanni; Lipparini, Filippo

Washington, DC (2019)
Fachzeitschriftenartikel

In: Journal of chemical theory and computation : JCTC
Band: 15
Heft: 11
Seite(n)/Artikel-Nr.: 6061-6073