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  • Currently displaying 26961 - 26980 of 29554 publications
Author(s)
Publication title
Journal Name
Publication year
A STUDY ON THE REACTION-MECHANISM OF METHANOL CONVERSION TO HYDROCARBONS BY SOLID-STATE NMR AND GAS-CHROMATOGRAPHY ON A SAPO-34 CATALYST
Y XU, C GREY, J THOMAS, A CHEETHAM
CATALYTIC SCIENCE AND TECHNOLOGY, VOL 1
(1991)
1
Theoretical study of some small van der waals complexes containing inert gas atoms
DJ Wales
Molecular Physics
(1991)
74
rearrangements in polyhedral boranes and metal clusters
DMP Mingos, DJ Wales
electron deficient boron and carbon clusters
(1991)
"Characterisation of Unfolded and Partially Folded States of Proteins by NMR Spectroscopy", in Conformations and Forces in Protein Folding
CM Dobson, C Hanley, SE Radford, J Baum, PA Evans
(1991)
PACKING SCHEMES FOR LENNARD-JONES CLUSTERS OF 13 TO 150 ATOMS - MINIMA, TRANSITION-STATES AND REARRANGEMENT MECHANISMS
J Uppenbrink, DJ Wales
\jcsft
(1991)
87
THE CALCULATION OF INTERMOLECULAR POTENTIALS
AJ STONE
ADVANCES IN BIOMOLECULAR SIMULATIONS
(1991)
239
METHODS FOR CALCULATING INTERMOLECULAR POTENTIAL-ENERGY SURFACES
AJ STONE
HYDROGEN-BONDED LIQUIDS
(1991)
329
Photodoping of amorphous chalcogenides by metals
AV Kolobov, SR Elliott
Advances In Physics
(1991)
40
LOCAL INTERPRETATION OF CHAOTIC DYNAMICS IN A MANY-BODY CLASSICAL HAMILTONIAN SYSTEM
DJ Wales, RS Berry
J. Phys. B
(1991)
24
Diode laser infrared spectroscopy of jet-cooled hexacarbonyls of chromium, molybdenum, and tungsten
J-R Burie, PB Davies, GM Hansford, NA Martin, J Gang, DK Russell
Molecular Physics
(1991)
74
STABILIZATION OF BARNASE BY AN INTERACTION BETWEEN 2 OPPOSITELY CHARGED SIDE-CHAINS
D SALI, M BYCROFT, AR FERSHT
TECHNIQUES IN PROTEIN CHEMISTRY II
(1991)
On the anisotropy of diffusion in nematic liquid crystals: test of a modified affine transformation model via molecular dynamics
S Hess, D Frenkel, MP Allen
Molecular Physics
(1991)
74
SKELETAL REARRANGEMENTS IN CLUSTERS - SOME NEW THEORETICAL INSIGHTS INVOLVING LIPSCOMB DIAMOND-SQUARE-DIAMOND MECHANISM
DMP MINGOS, DJ WALES
ELECTRON DEFICIENT BORON AND CARBON CLUSTERS
(1991)
THEORETICAL-STUDY OF SOME SMALL VANDERWAALS COMPLEXES CONTAINING INERT-GAS ATOMS
DJ Wales
\molphys
(1991)
74
STRUCTURE AND DYNAMICS OF REACTIVE TRANSITION-STATES - GENERAL DISCUSSION
A HODGSON, BE HAYDEN, DG TRUHLAR, R RANDALL, T TRUONG, AW KLEYN, J MANZ, MH ALEXANDER, S HOLLOWAY, AD BUCKINGHAM, ST CEYER, JJ VALENTINI, M SHAPIRO, MHP ARDEBILI, CJ HUGHES, JC WHITEHEAD, R GRICE, MA CHESTERS, JC POLANYI, RA MARCUS, H METIU, AH ZEWAIL
FARADAY DISCUSS
(1991)
91
General discussion
IWM Smith, JJ Valentini, DM Neumark, MNR Ashfold, M González, F Temps, A Laganà, JM Alvariño, LM Quintales, JC Polanyi, R Grice, DG Truhlar, KG McKendrick, FJ Aoiz, RS Mackay, Q-X Xu, VW-K Wu, DC Clary, B Soep, G Schatz, MS Child, M Shapiro, AH Zewail, H Metiu, JMC Plane, G Gerber, JE Combariza, J Manz, GK Paramonov, S Görtler, JP Simons, K Morokuma, E Kolba, R Kosloff, F Sondermann, VJ Herrero, VS Rábanos, KH Welge, B Girard, DE Manolopoulos, P Casavecchia, N Balucani, L Beneventi, D Stranges, GG Volpi, JM Bowman, RA Marcus, RT Pack, GA Parker, JNL Connor, DC Chatfield, RS Friedman, MGC Lynch, R Foster, MJ Frost, H Hippler, A Schlepegrell, J Troe, K-H Gericke, MH Alexander, PJ Dagdigian, SG Clement, JD Howe, CM Western, RN Dixon, PJ Sarre
Faraday Discuss. Chem. Soc.
(1991)
91
Energy and structure of the transition states in the reaction OH + CO → H + CO 2
MJ Frost, P Sharkey, IWM Smith
Faraday Discussions of the Chemical Society
(1991)
91
Professor R. B. Bernstein: An appreciation
AD Buckingham
Faraday Discussions of the Chemical Society
(1991)
91
Lithiations of mercaptoamines containing NC(S)NH–,–NHC(S)S– and –NHC(S)NH– units: syntheses, crystal structures and model molecular-orbital calculations
DR Armstrong, RE Mulvey, D Barr, RW Porter, PR Raithby, TRE Simpson, R Snaith, DS Wright, K Gregory, P Mikulcik
J. Chem. Soc., Dalton Trans.
(1991)
Synthesis, structure and isomerism of [Mn2(µ-PPhR)2(CO)8](R = H, alkyl, acyl or carboxylate); crystal structures of trans-[Mn2(µ-PPhR)2(CO)8](R = H or COMe)
MP Brown, J Buckett, MM Harding, RM Lynden-Bell, MJ Mays, KW Woulfe
J. Chem. Soc., Dalton Trans.
(1991)