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Currently displaying 22721 - 22740 of 29676 publications

Towards the chemical Semantic Web

P Murray-Rust, HS Rzepa

PROCEEDINGS OF THE 2002 INTERNATIONAL CHEMICAL INFORMATION CONFERENCE

(2002)

127

The use of XANES and ELNES for the characterisation of stabilised zirconia

DW McComb, S Ostanin, D Vlachos, AJ Craven, MW Finnis, AT Paxton, A Alavi

Materials Research Society Symposium Proceedings

(2002)

699

161

Modular assembly of porphyrin sandwiches as potential hosts

CA Hunter, R Tregonning

Tetrahedron

(2002)

691

(doi: 10.1016/S0040-4020(01)01107-3)

Coverage dependence of the dissociative sticking probability of methane on Pt(1 1 0)-(1 × 2)

DTP Watson, J van Dijk, JJW Harris, DA King

Surface Science

(2002)

506

243

(doi: 10.1016/S0039-6028(02)01315-8)

Diatomics-in-molecules potentials incorporating ab initio data:: Application to ionic, Rydberg-excited, and molecule-doped rare gas clusters

FY Naumkin, DJ Wales

Computer Physics Communications

(2002)

145

141

(doi: 10.1016/s0010-4655(02)00151-0)

Ag-Catalysed Epoxidation of Propene and Ethene: An Investigation Using Electrochemical Promotion of the Effects of Alkali, NOX, and Chlorine

A Palermo, A Husain, MS Tikhov, RM Lambert

Journal of Catalysis

(2002)

207

331

(doi: 10.1006/jcat.2002.3509)

H2−D2 exchange and migration of Ga in H-ZSM5 and H-MOR zeolites

M Garcia-Sanchez, P Magusin, EJM Hensen, RA van Santen

(2002)

142

959

(doi: 10.1016/s0167-2991(02)80124-0)

The superstructure of lead tetragonal tungsten bronze

SK Haydon, DA Jefferson

Journal of Solid State Chemistry

(2002)

168

306

(doi: 10.1006/jssc.2002.9630)

Energetics of enzyme stability

M Vendruscolo

Trends in Biotechnology

(2002)

(doi: 10.1016/S0167-7799(01)01871-6)

Cation ordering and electrochemical properties of the cathode materials LiZnxMn2-xO4, 0 < x ≤ 0.5: A 6Li magic-angle spinning NMR spectroscopy and diffraction study

YJ Lee, S-H Park, C Eng, JB Parise, CP Grey

Chemistry of Materials

(2002)

{194-205}

(doi: 10.1021/cm010503j)

New Look and New Outlook

WA Hendrickson, C-I Brändén, AR Fersht

Structure

(2002)

(doi: 10.1016/s0969-2126(01)00704-3)

What can classical simulators learn from ab initio simulations?

L Delle Site, RM Lyndeb-Bell, A Alavi