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  • Currently displaying 28361 - 28380 of 30444 publications
Author(s)
Publication title
Journal Name
Publication year
Longitudinal NMR relaxation of 27Al nuclei in zeolites
J Haase, H Pfeifer, W Oehme, J Klinowski
Chemical Physics Letters
(1988)
150
RATE CONSTANTS FOR THE REACTIONS CN(V=0), CN(V=1)+H2, D2-]HCN, DCN+H, D BETWEEN 295-K AND 768-K, AND COMPARISONS WITH TRANSITION-STATE THEORY CALCULATIONS
IR Sims, IWM Smith
Chemical Physics Letters
(1988)
149
STRUCTURE AND PROPERTIES OF RARE-EARTH OVERLAYERS AND ULTRA-THIN ALLOY-FILMS ON SINGLE-CRYSTAL COPPER - ND ON CU(111)
RM Nix, RW Judd, RM Lambert
Surface Science
(1988)
203
Ab initio quantum chemistry on microcomputers
SM Colwell, NC Handy
Computational and Theoretical Chemistry
(1988)
47
A VARIATIONAL METHOD FOR THE DETERMINATION OF THE VIBRATIONAL (J=0) ENERGY-LEVELS OF ACETYLENE, USING A HAMILTONIAN IN INTERNAL COORDINATES
S Carter, NC Handy
Computer Physics Communications
(1988)
51
The accurate calculation of molecular properties by ab initio methods
RD Amos, JF Gaw, NC Handy, S Carter
Journal of the Chemical Society Faraday Transactions 2 Molecular and Chemical Physics
(1988)
84
Molecular model for aqueous ferrous–ferric electron transfer
RA Kuharski, JS Bader, D Chandler, M Sprik, ML Klein, RW Impey
The Journal of Chemical Physics
(1988)
89
LONGITUDINAL NMR RELAXATION OF AL-27 IN ZEOLITES IS GOVERNED BY QUADRUPOLE INTERACTIONS WITH ADSORBED POLAR-MOLECULES AND EXCHANGEABLE CATIONS
J Haase, H Pfeifer, W Oehme, J Klinowski
Chemical Communications
(1988)
Determination of an adlayer bonding transition by surface extended X-ray-absorption fine-structure spectroscopy: Cesium adsorbed on Ag {111}
GM Lamble, RS Brooks, DA King, D Norman
Phys Rev Lett
(1988)
61
Solid-state NMR studies of the geometry of brønsted acid sites in zeolitic catalysts
D Freude, J Klinowski, H Hamdan
Chemical Physics Letters
(1988)
149
Experimental evidence for an inorganic molecular glass.
DJ Verrall, SR Elliott
Phys Rev Lett
(1988)
61
High selectivity catalysts for the oxidative coupling of methane
RK Ungar, X Zhang, RM Lambert
Applied Catalysis
(1988)
42
MOLLER-PLESSET 3RD ORDER CALCULATIONS WITH LARGE BASIS-SETS
IL Alberts, NC Handy
The Journal of Chemical Physics
(1988)
89
A cellular ligand-field model for ‘l-l’ spectral intensities
CA Brown, MJ Duer, M Gerloch, RF McMeeking
Molecular Physics
(1988)
64
A cellular ligand-field model for 'l-l' spectral intensities II. Applications within the d block
CA Brown, MJ Duer, M Gerloch, RF McMeeking
Molecular Physics
(1988)
64
Recent Advances in Solid-State NMR of Zeolites
J Klinowski
Annual Review of Materials Research
(1988)
18
New directions in gas scattering
DA King
Nature
(1988)
334
Optimization of a distributed Gaussian basis set using simulated annealing: Application to the adiabatic dynamics of the solvated electron
M Sprik, ML Klein
Journal of Chemical Physics
(1988)
89
HYDRATION OF TRICALCIUM SILICATE WITH D2O
TC King, CM Dobson, SA Rodger
Journal of Materials Science Letters
(1988)
7
TYROSYL-TRANSFER RNA-SYNTHETASE ACTS AS AN ASYMMETRIC DIMER IN CHARGING TRANSFER-RNA - A RATIONALE FOR HALF-OF-THE-SITES ACTIVITY
WHJ WARD, AR FERSHT
BIOCHEMISTRY-US
(1988)
27