Close Icon
 
Scheduled maintenance work on Thursday 19th January 2016 between 00:00 and 06:00 hours (GMT)
One of our internet service providers will be performing maintenance upgrade work on their network which means you may experience an intermittent reduction in performance, with the possibility of our publishing platform services being offline temporarily. If you have any questions, please use the feedback button on this page. We apologise for any inconvenience this might cause and thank you for your patience.

Journal of Materials Chemistry

Journal of Materials Chemistry was published between 1991 and 2012. From issue 1, 2013, it was replaced by three new journals: Journal of Materials Chemistry A, B and C

Paper

QM/MM modelling of the TS-1 catalyst using HPCx

a
Davy Faraday Research Laboratory, The Royal Institution of Great Britain, 21 Albemarle Street, London, UK
E-mail: richard@ri.ac.uk
Fax: +44 (0)20 7670 2958
Tel: +44 (0)20 7670 2901
b
CCLRC Daresbury Laboratory, Keckwick Lane, Daresbury, Warrington, UK
E-mail: p.sherwood@dl.ac.uk
Fax: +44 1925 603634
Tel: +441925 603553
J. Mater. Chem., 2006,16, 1919-1926

DOI: 10.1039/B601089J
Received 23 Jan 2006, Accepted 22 Mar 2006
First published online 12 Apr 2006
Please wait while Download options loads