Implementation of the Bethe−Salpeter equation in the TURBOMOLE program
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DOI: 10.1002/jcc.24688
Abstract: A software update solving the Bethe−Salpeter equation (BSE) is reported for the ESCF module of the TURBOMOLE program for the theoretical description of electronically excited states of atoms and molecules. A resolution‐of‐the‐identity (RI) approximation is… read more here.
Keywords: equation; salpeter equation; bethe salpeter; turbomole program ... See more keywords