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  • Currently displaying 28461 - 28480 of 30378 publications
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JP Simons, JC Polanyi, AD Buckingham, RN Zare, PJ Kuntz, R Grice, GN Robinson, DH Parker, MHM Janssen, DW Chandler
Faraday Discussions of the Chemical Society
(1987)
84
MODEL FOR THE ELECTRICAL DOPING OF CHALCOGENIDE GLASSES BY BISMUTH.
SR Elliott
Disord Semicond
(1987)
ARTIFACTS IN THE APPLICATION OF LINEAR FREE-ENERGY ANALYSIS
AR FERSHT
PROTEIN ENGINEERING
(1987)
1
SYNTHESIS, CHEMISTRY, ELECTRONIC PROPERTIES, AND MAGNETISM IN THE Y-Ba-Cu-O SUPERCONDUCTOR SYSTEMS. .
R Jones, MF Ashby, AM Campbell, PP Edwards, MR Harrison, AD Hibbs, DA Jefferson, AI Kirkland, T Thanyasiri, E Sinn
ACS Symposium Series
(1987)
Closed-shell structures and the building game
DJ Wales
Chemical Physics Letters
(1987)
141
Tests of photochemical and dynamical theories from satellite data
JA Pyle, AM Zavody, LJ Gray
Philosophical Transactions Royal Society of London A
(1987)
323
Photoinduced changes of ac transport in amorphousAs2S3films
K Shimakawa, K Hattori, SR Elliott
Physical Review B
(1987)
36
Optimization of a distributed Gaussian basis set using simulated annealing: Application to the solvated electron
M Sprik, ML Klein
The Journal of Chemical Physics
(1987)
87
The preparation and X-ray structure of naphthalenedithiadiphosphetanedisulphide
AMZ Slawin, DJ Williams, PT Wood, JD Woollins
Chemical Communications
(1987)
The analytic configuration interaction gradient method: The calculation of one electron properties
APL Rendell, GB Bacskay, NS Hush, NC Handy
The Journal of Chemical Physics
(1987)
87
The structure and vibrational frequencies of the ArH3+ ion and its isotopomers
ED Simandiras, JF Gaw, NC Handy
Chemical Physics Letters
(1987)
141
Prediction of electrostatic effects of engineering of protein charges.
MJ Sternberg, FR Hayes, AJ Russell, PG Thomas, AR Fersht
Nature
(1987)
330
Magic-angle-spinning NMR shows the aluminosilicate framework of ultramarine to be disordered
J Klinowski, SW Carr, SE Tarling, P Barnes
Nature
(1987)
330
Preparation and use of tetra-n-butylammonium per-ruthenate (TBAP reagent) and tetra-n-propylammonium per-ruthenate (TPAP reagent) as new catalytic oxidants for alcohols
WP Griffith, SV Ley, GP Whitcombe, AD White
Journal of the Chemical Society Chemical Communications
(1987)
COMBINING TRANSITION-STATE THEORY WITH QUASI-CLASSICAL TRAJECTORY CALCULATIONS .3. APPLICATIONS TO THE 3-DIMENSIONAL H+H-2(NU) REACTION
RJ Frost, IWM Smith
Chemical Physics
(1987)
117
EFFECTIVE MOLARITIES FOR INTRAMOLECULAR HYDRIDE TRANSFER - REDUCTION BY 1,4-DIHYDROPYRIDINES OF THE NEIGHBORING ALPHA-KETOESTER GROUP
AJ KIRBY, DR WALWYN
GAZZ CHIM ITAL
(1987)
117
Soft-sphere model for the glass transition in binary alloys: Pair structure and self-diffusion
B Bernu, JP Hansen, Y Hiwatari, G Pastore
Physical Review A
(1987)
36
THE IMPACT OF SUPERCOMPUTERS ON CHEMISTRY - INTERNATIONAL-CONFERENCE HELD AT UNIVERSITY-OF-LONDON, APRIL, 1987
NC HANDY
THEOR CHIM ACTA
(1987)
72
Combining transition state theory with quasiclassical trajectory calculations: application to the nitrogen exchange reaction N+N2(v)
RJ Frost, IWM Smith
Chemical Physics Letters
(1987)
140
The influence of cross correlation on multiplet patterns in nuclear overhauser effect spectra
J Keeler, F Sánchez-Ferrando
Journal of Magnetic Resonance (1969)
(1987)
75