| Literature DB >> 22519307 |
Abstract
This perspective article discusses some broadly-known and some less broadly-known consequences of Einstein's special relativity in quantum chemistry, and provides a brief outline of the theoretical methods currently in use, along with a discussion of recent developments and selected applications. The treatment of the electron correlation problem in relativistic quantum chemistry methods, and expanding the reach of the available relativistic methods to calculate all kinds of energy derivative properties, in particular spectroscopic and magnetic properties, requires on-going efforts.Year: 2012 PMID: 22519307 DOI: 10.1063/1.3702628
Source DB: PubMed Journal: J Chem Phys ISSN: 0021-9606 Impact factor: 3.488