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- Currently displaying 25601 - 25620 of 29382 publications
Implementation of Analytic Derivative Density Functional Theory codes on scalar and parallel architectures
– E.C.C.C. 1 COMPUTATIONAL CHEMISTRY
(1995)
330,
3
The next homologue of the bis(cyclopentadienyl)thallate anion; synthesis and X-ray structure determination of [(η 5 -C 5 H 5 )Tl(µ-C 5 H 5 )Tl(µ 5 -C 5 H 5 )] – [Li(12-crown-4) 2 ] + ·thf
– J. Chem. Soc., Chem. Commun.
(1995)
927
(doi: 10.1039/c39950000927)
Electrochemical Promotion of the No + Ethylene Reaction over Platinum
– Journal of Catalysis
(1995)
152,
211
(doi: 10.1006/jcat.1995.1075)
POTENTIAL-ENERGY SURFACES OF SEVERAL VAN-DER-WAALS COMPLEXES MODELED USING DISTRIBUTED MULTIPOLES
– Chem. Phys. Lett.
(1995)
240,
89-96
REACTION-PATH ZERO-POINT ENERGY FROM DIFFUSION MONTE- CARLO CALCULATIONS
– J. Chem. Phys.
(1995)
102,
1592-1596
Influence of surface topology and electrostatic potential on water/electrode systems
– The Journal of Chemical Physics
(1995)
102,
511
(doi: 10.1063/1.469429)
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)
On the absolute stereochemistries of homochiral cycloadducts derived from oxygenated aldoximes and divinyl sulfone via azaprotio cyclotransfer.
– Tetrahedron
(1995)
51,
6835
(doi: 10.1016/0040-4020(95)00316-z)
A detailed study of VESPA electrostatic potential-derived atomic charges
– Molecular Modeling Annual
(1995)
1,
176
(doi: 10.1007/s008940050014)
LOW-TEMPERATURE SINGLE-CRYSTAL X-RAY-DIFFRACTION, H-1 AND C-13 SOLID-STATE NMR AND N-14 NQR STUDIES OF 1,8-BIS(DIMEAHYLAMINO)NAPHTHALENE
– Physical Chemistry Chemical Physics
(1995)
91,
3925
(doi: 10.1039/FT9959103925)
Resolution without solution: Retrieving anisotropic information in solid-state NMR
– BULLETIN OF MAGNETIC RESONANCE, VOL 17, NOS 1-4, DECEMBER 1995
(1995)
27
A mixed organozinc–diorganophosphide complex containing protic phosphine ligands bonded to zinc
– Chemical Communications
(1995)
1989
(doi: 10.1039/c39950001989)
Folding and binding
– Current Opinion in Structural Biology
(1995)
5,
56
(doi: 10.1016/0959-440X(95)80009-P)
Atmospheric chemistry: Measurements, mechanisms and models - General discussion
– FARADAY DISCUSS
(1995)
100,
199
Senile neurodegeneration: Pathogenic role of microglia-derived free radicals
– OXIDATIVE STRESS AND AGING
(1995)
319
Folding & Design: introduction to a new journal
– Structure
(1995)
1,
i
X-ray photoelectron spectroscopic studies of kaolinite and montmorillonite
– Vacuum
(1995)
46,
1391
(doi: 10.1016/0042-207x(95)00159-x)
GRADIENT PATHS OF THE REACTIONS OF ELECTROPHILIC ADDITION OF HF TO ETHYLENE AND 1,2-H-SHIFT IN H2PN
– J. Struct. Chem.
(1995)
36,
525-537
Atmospheric chemistry: Measurements, mechanisms and models - General discussion
– FARADAY DISCUSS
(1995)
100,
279