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- Currently displaying 23501 - 23520 of 29867 publications
Kinetic energy functionals from the Kohn–Sham potential
Physical Chemistry Chemical Physics
(2000)
2
5049
(doi: 10.1039/b005896n)
Synthesis of mesostructured aluminophosphates using cationic templating
Physical Chemistry Chemical Physics
(2000)
2
5275
(doi: 10.1039/b004928j)
Sum frequency generation on surfactant-coated gold nanoparticles
Journal of the American Chemical Society
(2000)
122
12031
(doi: 10.1021/ja002785e)
A new highly efficient catalyst system for the coupling of nonactivated and deactivated aryl chlorides with arylboronic acids
Angewandte Chemie
(2000)
39
4153
A Li(10) Cage Containing the
Angewandte Chemie (International ed. in English)
(2000)
39
4145
Three-wave mixing in chiral liquids.
Physical review letters
(2000)
85
4253
(doi: 10.1103/PhysRevLett.85.4253)
A variational method for the calculation of spin-rovibronic energy levels of triatomic molecules with three interacting electronic states
Molecular Physics
(2000)
98
1697
(doi: 10.1080/00268970009483375)
FRET Fluctuation Spectroscopy: Exploring the Conformational Dynamics of a DNA Hairpin Loop
Journal of Physical Chemistry B
(2000)
104
11551
(doi: 10.1021/jp001560n)
Two interacting electrons in a box: An exact diagonalization study
Journal of Chemical Physics
(2000)
113
7735
(doi: 10.1063/1.1316045)
Predictions of rotation-vibration effects in time-resolved photoelectron angular distributions
The Journal of Chemical Physics
(2000)
113
7901
(doi: 10.1063/1.1315356)
Conformationally stressed phthalocyanines: the non-planarity of the 1,4,8,11,15,18,22,25-octaisopentyl derivative
Chemical Communications
(2000)
2133
(doi: 10.1039/b006935n)
Hydrothermal crystal engineering using hard and soft acids and bases: synthesis and X-ray crystal structures of the metal hydroxide-based phases M3M′2(OH)2[NC5H3(CO2)2-2,4]4(H2O)4 (M = Co, Ni, Zn; M′ = Pd, Pt)
Chemical Communications
(2000)
2107
(doi: 10.1039/b006094l)
19F/23Na double resonance MAS NMR study of oxygen/fluorine ordering in the oxyfluoride Na5W3O9F5
Chemistry of Materials
(2000)
12
3611
(doi: 10.1021/cm000355h)
Electrochemical promotion of catalytic reactions using alkali ion conductors
Solid State Ionics
(2000)
136-137
677
Successful application of electrochemical promotion to the design of effective conventional catalyst formulations
Solid State Ionics
(2000)
136-137
783
Elastic constant calculations for molecular organic crystals
Crystal Growth and Design
(2000)
1
13
(doi: 10.1021/cg0055070)
Comparison of two optimization methods to derive energy parameters for protein folding: Perceptron and Z score
Proteins: Structure, Function, and Genetics
(2000)
41
192
Binding of vancomycin group antibiotics to D-alanine and D-lactate presenting self-assembled monolayers
Bioorganic & Medicinal Chemistry
(2000)
8
2609
Trapping the tetrahedral intermediate in the 1,3-shift of an acetyl group using a triisopropylsilyl group
JOURNAL OF THE INDIAN CHEMICAL SOCIETY
(2000)
77
593
Influence of receptor number on functional responses elicited by agonists acting at the human adenosine A1 receptor: Evidence for signaling pathway-dependent changes in agonist potency and relative intrinsic activity
Mol Pharmacol
(2000)
58
1075
(doi: 10.1124/mol.58.5.1075)