Using automatic differentiation to compute derivatives for aquantum-chemical computer program

Steiger, Rainer; Bischof, Christian; Lang, Bruno; Thiel, Walter

Amsterdam : Elsevier [u.a.] (2005)
Journal Article

In: Future generation computer systems : FGCS
Volume: 21
Issue: 8
Page(s)/Article-Nr.: 1324-1332

Identifier