Theoretical Chemistry of Gold - Pyykkö - 2004 - Angewandte Chemie International Edition - Wiley
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The importance of the selective activation of alkanes for science and technology in the
forthcoming decades does not need to be explicitly pointed out in this thematic issue of …

Understanding the energy it takes to build or break chemical bonds is essential for scientists
and engineers in a wide range of innovative fields, including catalysis, nanomaterials …

We suggest a new degradation mechanism of commonly used gold electrodes in hybrid
perovskite solar cells (PSCs) originating from chemical interaction between gold and highly …

Gas‐phase experiments provide information which, in conjunction with results from
electronic structure calculations, help to unravel the critical role relativistic effects play in …

With the objective of analyzing which kind of reference data is appropriate for benchmarking
quantum chemical approaches for transition metal compounds, we present the following,(a) …

The nature of the chemical bond between gold and the noble gases in the simplest
prototype of Au (I) complexes (NgAuF and NgAu+, where Ng= Ar, Kr, Xe), has been …

Abstract Die besonderen Eigenschaften des Golds sind entscheidend durch relativistische
Effekte bestimmt. Mittlerweile existiert eine Vielzahl zuverlässiger Rechnungen zu …

The scope and mechanism of the microenvironment-catalyzed C (sp3)− C (sp3) reductive
elimination from transition metal complexes [Au (III), Pt (IV)] is explored. Experiments …

Two unique organometallic halide series (Ph3P) Au (4-Me-C6H4)(CF3)(X) and (Cy3P) Au (4-
F-C6H4)(CF3)(X)(X= I, Br, Cl, F) have been synthesized. The PPh3-supported complexes …