Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5390081 | Chemical Physics Letters | 2008 | 4 Pages |
Abstract
The non-planar geometry of the palladium(II) acetylacetonate molecule observed experimentally in a crystal lattice was successfully reproduced with planewave-pseudopotential density-functional theory.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Samir H. Mushrif, Alejandro D. Rey, Gilles H. Peslherbe,