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- Currently displaying 21061 - 21080 of 30196 publications
Intermolecular forces in van der waals dimers
International Journal of Quantum Chemistry
(2004)
29
1223
(doi: 10.1002/qua.560290520)
The calculation of frequency‐dependent hyperpolarizabilities including electron correlation effects
International Journal of Quantum Chemistry
(2004)
43
91
(doi: 10.1002/qua.560430110)
Implications of unitary invariance for gradient theory
International Journal of Quantum Chemistry
(2004)
42
445
(doi: 10.1002/qua.560420307)
Higher analytic derivatives. I. A new implementation for the third derivative of the SCF energy
International Journal of Quantum Chemistry
(2004)
40
179
(doi: 10.1002/qua.560400203)
TIME-RESOLVED VIBRATIONAL CHEMILUMINESCENCE - RATE CONSTANTS FOR THE REACTIONS OF F-ATOMS WITH H2O AND HCN, AND FOR THE RELAXATION OF HF (V = 1) BY H2O AND HCN
International Journal of Chemical Kinetics
(2004)
18
885
(doi: 10.1002/kin.550180808)
The role of electronically excited states in recombination reactions
International Journal of Chemical Kinetics
(2004)
16
423
(doi: 10.1002/kin.550160411)
Rate data for O + OCS → SO + CO and SO + O3 → SO2 + O2 by a new time‐resolved technique
International Journal of Chemical Kinetics
(2004)
12
729
(doi: 10.1002/kin.550121006)
ABSOLUTE RATE CONSTANTS FOR REACTIONS OF O(P-3) ATOMS WITH DCL AND DBR
International Journal of Chemical Kinetics
(2004)
10
1
(doi: 10.1002/kin.550100102)
ABSOLUTE RATE CONSTANTS FOR REACTIONS O(P-3) ATOMS WITH HCL AND HBR
International Journal of Chemical Kinetics
(2004)
7
301
(doi: 10.1002/kin.550070211)
Electrochemical activity of Li in the transition-metal sites of O3 Li[Li(1-2x)/3Mn(2-x)/3Ni x]O2
Electrochemical and Solid State Letters
(2004)
7
{A290-A293}
(doi: 10.1149/1.1783113)
Three- and four-body interactions in colloidal systems
Proceedings of SPIE--the International Society for Optical Engineering
(2004)
5514
340
(doi: 10.1117/12.554610)
Identification of organic acids in secondary organic aerosol and the corresponding gas phase from chamber experiments
Analytical chemistry
(2004)
76
6535
(doi: 10.1021/ac048975f)
Breakdown of classical nucleation theory near isostructural phase transitions
Phys Rev Lett
(2004)
93
1
Thin-film metal catalyst for the production of multi-wall and single-wall carbon nanotubes
Journal of Applied Physics
(2004)
96
4456
(doi: 10.1063/1.1794359)
Molecular similarity: a key technique in molecular informatics.
Org Biomol Chem
(2004)
2
3204
(doi: 10.1039/B409813G)
Studying nanoparticle-induced structural changes within fatty acid multilayer films using sum frequency generation vibrational spectroscopy
Journal of the American Chemical Society
(2004)
126
14322
(doi: 10.1021/ja046954x)
Synthesis and stability of small molecule probes for Pseudomonas aeruginosa quorum sensing modulation.
Organic and Biomolecular Chemistry
(2004)
2
3329
(doi: 10.1039/B412802H)
CMLSnap: Animated reaction mechanisms
INTERNET J CHEM
(2004)
7
ARTN 4