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Hydrophobic and Hydrogen-Bonding Effects on the Rate of Diels−Alder Reactions in Aqueous Solution
American Chemical Society | 1996| -
Hydrophobic and Hydrogen-Bonding Effects on the Rate of Diels-Alder Reactions in Aqueous Solution
Online Contents | 1996| -
Implementation of a Parallel Direct SCF Algorithm on Distributed Memory Computers
Online Contents | 1995| -
Theory of spin‐orbit coupling. Application to singlet–triplet interaction in the trimethylene biradical
National licenceAmerican Institute of Physics | 1985| -
Comparison of the performance of exact-exchange-based density functional methods
National licenceAmerican Institute of Physics | 2012| -
Combined X-ray Diffraction and Density Functional Study of [Ni(NO)(η5-Cp*)] in the Ground and Light-Induced Metastable States
American Chemical Society | 1998| -
Metastable Decomposition of {ROH} n H+ Cluster Ions (Where R = CH3 or CH3CH2)
National licenceAmerican Chemical Society | 1996| -
Spin-orbit coupling in biradicals. Ab initio MCSCF calculations on trimethylene and the methyl-methyl radical pair
National licenceAmerican Chemical Society | 1987| -
Transition states for H atom transfer reactions in the CH2CH2OH radical: The effect of a water molecule
National licenceRoyal Society of Chemistry | 2003|
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