Re: CCL:Al2O3
Dear Allouche,
On Feb 4, 5:53pm, Allouche Alain wrote:
> Subject: CCL:Al2O3
> Hi all CCLers,
> I need references about ab initio or DFT calculation on Al2O3 clusters
> (or similar ionic-covalent systems). The main problem is how to saturate
> the oxygen bonds.
> Thanks a lot in advance
[...]
>-- End of excerpt from Allouche Alain
You'll find an excellent review on this topic in:
J. Sauer, Chem. Rev., 1989, 89, 199.
Regards, Marek Sierka
--
Marek Sierka
address: Zi. 306, Jaegerstr. 10-11, 10117 Berlin, Germany
e-mail: * official mas(-(at)-)qc.ag-berlin.mpg.de
* private nkjms(-(at)-)hotmail.com