AN AB-INITIO STUDY OF THE AGGREGATION OF LAUX MOLECULES AND [LAUL](-)IONS()[XAUX]()

Authors
PYYKKO P SCHNEIDER W BAUER A BAYLER A SCHMIDBAUR H
Citation
P. Pyykko et al., AN AB-INITIO STUDY OF THE AGGREGATION OF LAUX MOLECULES AND [LAUL](-)IONS()[XAUX](), Chemical communications, (12), 1997, pp. 1111-1112
Citations number
19
Categorie Soggetti
Chemistry
Journal title
Chemical communications → ACNP
ISSN journal
13597345
Issue
12
Year of publication
1997
Pages
1111 - 1112
Database
ISI
SICI code
1359-7345(1997):12<1111:AASOTA>2.0.ZU;2-4
Abstract
Pseudopotential ab initio calculations on dimers and tetramers of form ula {[(H3P)(2)Au]+[AuCl2](-)}(n), (n = 1, 2) which are the products of a ligand distribution of systems (H3PAuCl)(2n), show that the differe nt experimentally observed structures are actually energetically quite comparable.