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- Currently displaying 17361 - 17380 of 30398 publications
Coupled cluster benchmarks of water monomers and dimers extracted from density-functional theory liquid water: The importance of monomer deformations
Journal of Chemical Physics
(2009)
131
124509
(doi: 10.1063/1.3236840)
Hartree-Fock solutions as a quasidiabatic basis for nonorthogonal configuration interaction.
Journal of Chemical Physics
(2009)
131
124113
(doi: 10.1063/1.3236841)
Single-crystal-to-single-crystal [2 + 2] photodimerizations: from discovery to design
Zeitschrift für Kristallographie - Crystalline Materials
(2009)
220
351
(doi: 10.1524/zkri.220.4.351.61621)
Complementarity of experimental and theoretical nuclear magnetic resonance spectroscopic studies for the study of candidate ITSOFC electrolytes
SOLID OXIDE FUEL CELLS 11 (SOFC-XI)
(2009)
25
1709
(doi: 10.1149/1.3205709)
Measurements of the Rates of Reactions of Ground State Atomic Calcium, Ca[4s2(1S0)], with Alkyl Bromides at Elevated Temperature by Time-Resolved Atomic Resonance Absorption Spectroscopy [Ca(41P1 - 41S0); λ = 422.7 nm]
Zeitschrift für Physikalische Chemie
(2009)
215
1193
(doi: 10.1524/zpch.2001.215.9.1193)
Determination of the branching ratios of CaBr(A(2)Pi(1/2,3/2),B-2 Sigma(+)) resulting from the reaction of Ca[4s4p(P-3(J))] with CH3Br by time-resolved atomic emission and molecular chemiluminescence following pulsed dye-laser excitation of atomic calcium
Zeitschrift Fur Physikalische Chemie
(2009)
215
547
(doi: 10.1524/zpch.2001.215.5.547)
Large variations in the propensity of aqueous oxychlorine anions for the solution/vapor interface
The Journal of Chemical Physics
(2009)
131
124706
(doi: 10.1063/1.3236805)
Alpha Shapes Applied to Molecular Shape Characterization Exhibit Novel Properties Compared to Established Shape Descriptors
J Chem Inf Model
(2009)
49
2231
(doi: 10.1021/ci900190z)
What is cooperativity?
Angewandte Chemie International Edition
(2009)
48
7488
(doi: 10.1002/anie.200902490)
Short-lived bromine compounds in the lower stratosphere; impact of climate change on ozone
Atmospheric Science Letters
(2009)
10
201
(doi: 10.1002/asl.236)
Temperature dependence of heterogeneous uptake of N2O5 by ammonium sulfate aerosol
Atmospheric Sciences Letters
(2009)
10
159
Direct observation of barrier-limited folding of BBL by single-molecule fluorescence resonance energy transfer.
Proceedings of the National Academy of Sciences
(2009)
106
16239
(doi: 10.1073/pnas.0909126106)
Liquid as template for next generation micro devices
Journal of Physics Conference Series
(2009)
182
012021
General aspects of solid on liquid growth mechanisms
Journal of Physics: Conference Series
(2009)
182
012029
Discovery of specific flavodoxin inhibitors as potential therapeutic agents against Helicobacter pylori infection
ACS Chem Biol
(2009)
4
928
(doi: 10.1021/cb900166q)
Genetically Encoding Nε-Methyl-L-lysine in Recombinant Histones
J Am Chem Soc
(2009)
131
14194
(doi: 10.1021/ja906603s)
Surface thermodynamics: Small molecule adsorption calorimetry on metal single crystals
MODEL SYSTEMS IN CATALYSIS: SINGLE CRYSTALS TO SUPPORTED ENZYME MIMICS
(2009)
175
(doi: 10.1007/978-0-387-98049-2_9)
Ion specific effects of sodium and potassium on the catalytic activity of HIV-1 protease
Physical chemistry chemical physics : PCCP
(2009)
11
7599
(doi: 10.1039/b905462f)
Selective recognition and binding of arsenate over phosphate
Dalton Transactions
(2009)
9718
(doi: 10.1039/b918143c)
