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The Journal of Organic Chemistry
|
May 10, 2007
Rearrangement of the 1,1-diphenylethoxyl radical is not concerted but occurs through a bridged intermediate
Manuel Smeu, Gino A DiLabio
The Journal of Physical Chemistry Letters
|
August 21, 2015
A (Nearly) Universally Applicable Method for Modeling Noncovalent Interactions Using B3LYP
Edmanuel Torres, Gino A DiLabio
The Journal of Chemical Physics
|
May 17, 2014
Dispersion-correcting potentials can significantly improve the bond dissociation enthalpies and noncovalent binding energies predicted by density-functional theory
Gino A DiLabio, Mohammad Koleini
Journal of Chemical Theory and Computation
|
November 20, 2015
Density-Functional Theory with Dispersion-Correcting Potentials for Methane: Bridging the Efficiency and Accuracy Gap between High-Level Wave Function and Classical Molecular Mechanics Methods
Edmanuel Torres, Gino A DiLabio
The Journal of Physical Chemistry. A
|
October 3, 2008
Interactions in large, polyaromatic hydrocarbon dimers: application of density functional theory with dispersion corrections
Iain D Mackie, Gino A DiLabio
Organic Letters
|
December 15, 2006
Bond strengths: the importance of hyperconjugation
K U Ingold, Gino A DiLabio
Physical Chemistry Chemical Physics : PCCP
|
April 29, 2010
Accurate dispersion interactions from standard density-functional theory methods with small basis sets
Iain D Mackie, Gino A Dilabio
Journal of the American Chemical Society
|
April 21, 2007
Lone pair-pi and pi-pi interactions play an important role in proton-coupled electron transfer reactions
Gino A DiLabio, Erin R Johnson
The Journal of Organic Chemistry
|
February 28, 2004
Solvolysis of para-substituted cumyl chlorides. Brown and Okamoto's electrophilic substituent constants revisited using continuum solvent models
Gino A DiLabio, K U Ingold
Journal of the American Chemical Society
|
May 5, 2005
A theoretical study of the iminoxyl/oxime self-exchange reaction. A five-center, cyclic proton-coupled electron transfer
Gino A DiLabio, K U Ingold
Page
of 11
Search research articles
Search
Showing results (1-10 of 102) with videos related to
Sort By:
Page
of 11
The Journal of Organic Chemistry
|
May 10, 2007
Rearrangement of the 1,1-diphenylethoxyl radical is not concerted but occurs through a bridged intermediate
Manuel Smeu, Gino A DiLabio
The Journal of Physical Chemistry Letters
|
August 21, 2015
A (Nearly) Universally Applicable Method for Modeling Noncovalent Interactions Using B3LYP
Edmanuel Torres, Gino A DiLabio
The Journal of Chemical Physics
|
May 17, 2014
Dispersion-correcting potentials can significantly improve the bond dissociation enthalpies and noncovalent binding energies predicted by density-functional theory
Gino A DiLabio, Mohammad Koleini
Journal of Chemical Theory and Computation
|
November 20, 2015
Density-Functional Theory with Dispersion-Correcting Potentials for Methane: Bridging the Efficiency and Accuracy Gap between High-Level Wave Function and Classical Molecular Mechanics Methods
Edmanuel Torres, Gino A DiLabio
The Journal of Physical Chemistry. A
|
October 3, 2008
Interactions in large, polyaromatic hydrocarbon dimers: application of density functional theory with dispersion corrections
Iain D Mackie, Gino A DiLabio
Organic Letters
|
December 15, 2006
Bond strengths: the importance of hyperconjugation
K U Ingold, Gino A DiLabio
Physical Chemistry Chemical Physics : PCCP
|
April 29, 2010
Accurate dispersion interactions from standard density-functional theory methods with small basis sets
Iain D Mackie, Gino A Dilabio
Journal of the American Chemical Society
|
April 21, 2007
Lone pair-pi and pi-pi interactions play an important role in proton-coupled electron transfer reactions
Gino A DiLabio, Erin R Johnson
The Journal of Organic Chemistry
|
February 28, 2004
Solvolysis of para-substituted cumyl chlorides. Brown and Okamoto's electrophilic substituent constants revisited using continuum solvent models
Gino A DiLabio, K U Ingold
Journal of the American Chemical Society
|
May 5, 2005
A theoretical study of the iminoxyl/oxime self-exchange reaction. A five-center, cyclic proton-coupled electron transfer
Gino A DiLabio, K U Ingold
Page
of 11