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Yusuf Hamied Department of Chemistry

 

Publications

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  • Currently displaying 26761 - 26780 of 29372 publications
Central or distributed multipole moments? Electrostatic models of aromatic dimers
PW FOWLER, AD BUCKINGHAM
– Chemical Physics Letters
(1991)
176,
11
(doi: 10.1016/0009-2614(91)90003-r)
PLASMA SIMULATIONS USING THE CAR-PARRINELLO METHOD
J CLEROUIN, G ZERAH, JP HANSEN
– COMPUTER SIMULATION IN MATERIALS SCIENCE
(1991)
205,
467
(link to publication)
METHODS FOR CALCULATING INTERMOLECULAR POTENTIAL-ENERGY SURFACES
AJ STONE
– HYDROGEN-BONDED LIQUIDS
(1991)
329,
25
(link to publication)
The onset of disorder on a surface with a step
H Xu, RM Lynden-Bell
– Molecular Physics
(1991)
73,
1401
(doi: 10.1080/00268979100102001)
NOVEL ROUTES TO INOSITOL PHOSPHATES USING PSEUDOMONAS-PUTIDA OXIDATION OF ARENES
SV LEY, AJ REDGRAVE, LL YEUNG
– INOSITOL PHOSPHATES AND DERIVATIVES
(1991)
463,
132
(link to publication)
Assessment of a method for the measurement of long-range heteronuclear coupling constants
JM RICHARDSON, JJ TITMAN, J KEELER, D NEUHAUS
– Journal of Magnetic Resonance (1969)
(1991)
93,
533
(doi: 10.1016/0022-2364(91)90081-4)
Oxygen surface species on lithium nickelate methane coupling catalysts and their interaction with carbon oxides
GD MOGGRIDGE, JPS BADYAL, RM LAMBERT
– Journal of Catalysis
(1991)
132,
92
(doi: 10.1016/0021-9517(91)90250-8)
SURFACE OXIDE-FILMS AND H2/CO CHEMISORPTION AT THE RU/TIO2 INTERFACE - STUDIES WITH A MODEL PLANAR CATALYST
JPS BADYAL, RM LAMBERT
– Journal of Catalysis
(1991)
130,
173
(doi: 10.1016/0021-9517(91)90101-9)
Energy and structure of the transition states in the reaction OH + CO ? H + CO2
MJ FROST, P SHARKEY, IWM SMITH
– Faraday Discussions of the Chemical Society
(1991)
91,
305
(doi: 10.1039/dc9919100305)
Research note:Diode laser infrared spectroscopy of jet-cooled hexacarbonyls of chromium, molybdenum, and tungsten
JR BURIE, PB DAVIES, GM HANSFORD, NA MARTIN, J GANG, DK RUSSELL
– Molecular Physics
(1991)
74,
919
(doi: 10.1080/00268979100102691)
Tagged particle diffusion in 3d lattice gas cellular automata
MA VANDERHOEF, D FRENKEL
– Physica D: Nonlinear Phenomena
(1991)
47,
191
(doi: 10.1016/0167-2789(91)90289-L)
SYNTHESIS OF TETRAHYDROPYRAN-CONTAINING NATURAL-PRODUCTS
SV LEY
– HETEROCYCLES IN BIO-ORGANIC CHEMISTRY
(1991)
1
(link to publication)
THE CALCULATION OF INTERMOLECULAR POTENTIALS
AJ STONE
– ADVANCES IN BIOMOLECULAR SIMULATIONS
(1991)
239,
3
(link to publication)
General discussion
IWM SMITH, JJ VALENTINI, DM NEUMARK, MNR ASHFOLD, M GONZALEZ, F TEMPS, A LAGANA, JM ALVARINO, LM QUINTALES, JC POLANYI, R GRICE, DG TRUHLAR, KG MCKENDRICK, FJ AOIZ, RS MACKAY, QX XU, VWK 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, JE COMBARIZA, S GORTLER, J MANZ, JP SIMONS, K MOROKUMA, E KOLBA, J MANZ, R KOSLOFF, F SONDERMANN, FJ AOIZ, VJ HERRERO, VS RABANOS, KH WELGE, B GIRARD, DE MANOLOPOULOS, P CASAVECCHIA, N BALUCANI, L BENEVENTI, D STRANGES, GG VOLPI, JM BOWMAN, RA MARCUS, A LAGANA, RT PACK, GA PARKER, JNL CONNOR, DC CHATFIELD, RS FRIEDMAN, GC LYNCH, DG TRUHLAR, R FOSTER, MJ FROST, H HIPPLER, A SCHLEPEGRELL, J TROE, KH GERICKE, MNR ASHFOLD, SG CLEMENT, JD HOWE, CM WESTERN, RN DIXON, PJ SARRE
– Faraday Discuss. Chem. Soc.
(1991)
91,
337
(doi: 10.1039/dc9919100337)
PACKING SCHEMES FOR LENNARD-JONES CLUSTERS OF 13 TO 150 ATOMS - MINIMA, TRANSITION-STATES AND REARRANGEMENT MECHANISMS
J Uppenbrink, DJ Wales
– \jcsft
(1991)
87,
215-222
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)
143
(link to publication)
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 DISCUSSIONS
(1991)
91,
465
(doi: 10.1039/dc9919100465)
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
– Dalton Transactions
(1991)
765
(doi: 10.1039/dt9910000765)
Vapour-liquid equilibria of the hard core Yukawa fluid
B SMIT, D FRENKEL
– Molecular Physics
(1991)
74,
35
(doi: 10.1080/00268979100102031)
The Champagne Route to Avermectins and Milbemycins
SV Ley, A Armstrong
– Strategies and Tactics in Organic Synthesis
(1991)
3,
237
(doi: 10.1016/b978-0-08-092430-4.50013-5)

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