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- Currently displaying 25741 - 25760 of 29469 publications
1H/2H-Dimethyl Sulfone as a Convenient Standard for Setting the Hartmann-Hahn Match in 1H-2H CP/MAS NMR
– Journal of Magnetic Resonance Series A
(1995)
114,
70
(doi: 10.1006/jmra.1995.1106)
A detailed study of VESPA electrostatic potential-derived atomic charges
– Journal of Molecular Modeling
(1995)
1,
176
(doi: 10.1007/s008940050014)
Implementation of Analytic Derivative Density Functional Theory codes on scalar and parallel architectures
– E.C.C.C. 1 COMPUTATIONAL CHEMISTRY
(1995)
330,
3
Infrared laser and microwave spectroscopy of electric discharges
– Chemical Society Reviews
(1995)
24,
151
(doi: 10.1039/cs9952400151)
POTENTIAL-ENERGY SURFACES OF SEVERAL VAN-DER-WAALS COMPLEXES MODELED USING DISTRIBUTED MULTIPOLES
– Chem. Phys. Lett.
(1995)
240,
89-96
INFRARED-LASER SPECTROSCOPY OF THE NU(2) BAND OF DIFLUOROCARBENE (CF2)
– Journal of Molecular Spectroscopy
(1995)
169,
201
(doi: 10.1006/jmsp.1995.1016)
Influence of surface topology and electrostatic potential on water/electrode systems
– Journal of Chemical Physics
(1995)
102,
511
(doi: 10.1063/1.469429)
Gas-phase reactions and energy transfer at very low temperatures.
– Annual Review of Physical Chemistry
(1995)
46,
109
NMR study of whole rat bile: the biliary excretion of cefoperazone and benzyl chloride by an isolated perfused rat liver
– Journal of pharmaceutical and biomedical analysis
(1995)
13,
723
(doi: 10.1016/0731-7085(95)01264-L)
Low-temperature single-crystal X-Ray diffraction, 1 H and 13 C solid-state NMR and 14 N NQR studies of 1,8-bis(dimethyl-amino)naphthalene
– J. Chem. Soc., Faraday Trans.
(1995)
91,
3925
(doi: 10.1039/ft9959103925)
Adiabatic Pulses for Wideband Inversion and Broadband Decoupling
– Journal of Magnetic Resonance, Series A
(1995)
115,
273
(doi: 10.1006/jmra.1995.1179)
The adsorption of methanol on NiOx/Ni{110} Defect-controlled dissociation
– Chemical Physics Letters
(1994)
231,
481
(doi: 10.1016/0009-2614(94)01270-9)
27 Al and 29 Si solid-state NMR studies of dealuminated mordenite
– Journal of the Chemical Society Faraday Transactions
(1994)
90,
3719
(doi: 10.1039/ft9949003719)
Pressure and temperature dependence of the rate constants for the association reaction of OH radicals with NO between 301 and 23 K
– Physical Chemistry Chemical Physics
(1994)
90,
3609
(doi: 10.1039/ft9949003609)
Conformation of GroEL-bound alpha-lactalbumin probed by mass spectrometry.
– Nature
(1994)
372,
646
(doi: 10.1038/372646a0)
Anti aldol reactions of lactate-derived ketones: Application to the total synthesis of (-)-ACRL toxin IIIB
– Tetrahedron Letters
(1994)
35,
9477
Gradient corrections in density functional theory calculations for surfaces: Co on Pd{110}
– Chemical Physics Letters
(1994)
230,
501
(doi: 10.1016/0009-2614(94)01184-2)
Topography of potential-energy surfaces for Van der Waals complexes
– Faraday Discussions
(1994)
97,
243
(doi: 10.1039/fd9949700243)
Numerical study of the phase diagram of a mixture of spherical and rodlike colloids
– The Journal of Chemical Physics
(1994)
101,
9869
(doi: 10.1063/1.467953)
Isostructural solid-solid transition in crystalline systems with short-ranged interaction
– Phys Rev E Stat Phys Plasmas Fluids Relat Interdiscip Topics
(1994)
50,
4880
(doi: 10.1103/physreve.50.4880)