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  • Currently displaying 25941 - 25960 of 30298 publications
Author(s)
Publication title
Journal Name
Publication year
Ab initio molecular dynamics simulation of liquid water: Comparison three gradient-corrected density functionals
M Sprik, J Hutter, M Parrinello
Journal of Chemical Physics
(1996)
105
The N2 pressure broadening coefficient of the J = 1 ← 0 transition of ¹H35Cl measured by tunable far infrared (TuFIR) spectroscopy
CH Bryant, PB Davies, TJ Sears
Geophysical Research Letters
(1996)
23
Chemisorption and reactivity of furan on Pd{111}
RM Ormerod, CJ Baddeley, C Hardacre, RM Lambert
Surface Science
(1996)
360
Fragmentation of an imido tin(II) cubane; Syntheses and structures of heterobimetallic complexes containing tin(II) imido and phosphinidine anions
RE Allan, MA Beswick, NL Cromhout, MA Paver, PR Raithby, A Steiner, M Trevithick, DS Wright
Chemical Communications
(1996)
Chemistry of insect antifeedants from Azadirachta indica (part 21): Synthesis of model compounds of azadirachtin using a decalin framework as a functional group scaffolding
ML de la Puente, SV Ley, MSJ Simmonds, WM Blaney
JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 1
(1996)
Chemistry of insect antifeedants from Azadirachta indica .20. Synthesis of biologically active, simple analogues of azadirachtin, containing the hydroxytetrahydrofurancarboxylate hemiketal moiety
ML de la Puente, RB Grossman, SV Ley, MSJ Simmonds, WM Blaney
Journal of the Chemical Society, Perkin Transactions 1
(1996)
ESCA and solid-state NMR studies of ionic complexes of 1,8-bis(dimethylamino)naphthalene
K Wozniak, H He, J Klinowski, TL Barr, P Milart
The Journal of Physical Chemistry
(1996)
100
ESCA, solid-state NMR, and X-ray diffraction studies of perisubstituted naphthalene derivatives
K Wozniak, H He, J Klinowski, TL Barr, SE Hardcastle
Journal of Physical Chemistry
(1996)
100
Synthesis and structure of [Bi2(NtBu)4]2Li2·2THF; a bimetallic cubane fragment containing a [Bi2(NtBu)4]2− anion
AJ Edwards, MA Beswick, JR Galsworthy, MA Paver, PR Raithby, M-A Rennie, CA Russell, KL Verhorevoort, DS Wright
Inorganica Chimica Acta
(1996)
248
The shikimate pathway. Part 9. Halogenation at C-3 of the shikimate nucleus
R Brettle, R Cross, M Frederickson, E Haslam, FS MacBeath, GM Davies
Tetrahedron
(1996)
52
Alkali activation of reactive silicas in cements: in situ29Si MAS NMR studies of the kinetics of silicate polymerization
AR Brough, CM Dobson, IG Richardson, GW Groves
Journal of Materials Science
(1996)
31
Efficient alkylsulfanyl (SMe, SEt and SCH2Ph) and sulfanyl (SH) migration in the stereospecific synthesis of substituted tetrahydrofurans
J Eames, RVH Jones, S Warren
Tetrahedron Letters
(1996)
37
Solid phase reductive alkylation of secondary amines
NM Khan, V Arumugam, S Balasubramanian
Tetrahedron Letters
(1996)
37
The static polarizabilities and hyperpolarizabilities of LiH: electronic and vibrational contributions
MG PAPADOPOULOS, A WILLETTS, NC HANDY, AE UNDERHILL
Molecular Physics
(1996)
88
Statistical properties of the dense hydrogen plasma: An ab initio molecular dynamics investigation.
J Kohanoff, JP Hansen
Physical Review E
(1996)
54
Stereochemically controlled synthesis of 1,8-dioxaspiro[4.5]decanes and 1-oxa-8-thiaspiro[4.5]decanes by phenylsulfanyl migration
J Eames, MA de las Heras, RVH Jones, S Warren
Tetrahedron Letters
(1996)
37
Numerical calculation of the rate of crystal nucleation in a Lennard-Jones system at moderate undercooling
P Rein ten Wolde, MJ Ruiz-Montero, D Frenkel
Journal of Chemical Physics
(1996)
104
Alumination of the purely siliceous mesoporous molecular sieve MCM-41 and its hydrothermal conversion into zeolite Na-A
H Hamdan, S Endud, H He, MNM Muhid, J Klinowski
Physical Chemistry Chemical Physics
(1996)
92
Cold denaturation of barstar: 1H,15N and 13C NMR assignment and characterisation of residual structure
KB Wong, SM Freund, AR Fersht
Journal of Molecular Biology
(1996)
259
Reconstruction of Clean and Adsorbate-Covered Metal Surfaces.
S Titmuss, A Wander, DA King
Chem Rev
(1996)
96