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- Currently displaying 24701 - 24720 of 29303 publications
Higher-order gradient corrections for exchange-correlation functionals
Chemical Physics Letters
(1997)
266
16
Adsorption of ethyne on Cu(110): Experimental and theoretical study
Langmuir
(1997)
13
758
(doi: 10.1021/la960865j)
The use of a dithiane protected benzoin photolabile safety catch linker for solid-phase synthesis.
Tetrahedron Letters
(1997)
38
1227
Cyclobutanone as an electrophile for lithiated phosphine oxides: ‘Internal quench’ conditions
Journal of Organometallic Chemistry
(1997)
529
279
Experimental and molecular orbital calculational study of the stereoselective Horner—Wittig reaction with phosphine oxides: Control of stereoselectivity by lithium
Journal of Organometallic Chemistry
(1997)
529
29
Modified configurational bias monte carlo method for simulation of polymer systems
Journal of Chemical Physics
(1997)
106
2970
(doi: 10.1063/1.473356)
Distribution of tetrahedral and octahedral A1 sites in gamma alumina
Chemical Physics Letters
(1997)
265
673
On the accuracy of molecular exchange-correlation potentials computed from electron densities
Chemical Physics Letters
(1997)
265
614
In focus - Reply
SCIENCE
(1997)
275
912
Gradient Line Reaction Paths for Hindered Internal Rotation in H2BNH2 and Inversion in PF3
Journal of Physical Chemistry A
(1997)
101
1384
(doi: 10.1021/jp9628343)
An approach to the manzamine alkaloids modelled on a biogenetic theory
Tetrahedron
(1997)
53
2271
A spectroscopic study of the chemistry and reactivity of SO2 on Pt{111}: Reactions with O-2, CO and C3H6
Surface Science
(1997)
372
279
DNA base-stacking interactions: a comparison of theoretical calculations with oligonucleotide X-ray crystal structures11Edited by A. Klug
J Mol Biol
(1997)
265
603
(doi: 10.1006/jmbi.1996.0755)
Organic Molecular Solids
(1997)
Reactivity and Crystal Design in Organic Solid State Chemistry
(1997)
6
The folding pathway of a protein at high resolution from microseconds to seconds.
Proceedings of the National Academy of Sciences
(1997)
94
826
(doi: 10.1073/pnas.94.3.826)
Calorimetric investigation of NO and CO adsorption on Pd{100} and the influence of preadsorbed carbon
The Journal of Chemical Physics
(1997)
106
1990
(doi: 10.1063/1.473306)
Oxygen chemisorption and oxide film growth on Ni{100}, {110}, and {111}: Sticking probabilities and microcalorimetric adsorption heats
The Journal of Chemical Physics
(1997)
106
2012
(doi: 10.1063/1.473308)
Three‐dimensional chemical forecasting: A methodology
Journal of Geophysical Research
(1997)
102
3905
(doi: 10.1029/96JD00694)