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The Journal of Chemical Physics
|
April 26, 2013
Ab initio dynamics trajectory study of the heterolytic cleavage of H2 by a Lewis acid [B(C6F5)3] and a Lewis base [P(tBu)3]
Maoping Pu, Timofei Privalov
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
July 6, 2017
Computational Elucidation of a Role That Brønsted Acidification of the Lewis Acid-Bound Water Might Play in the Hydrogenation of Carbonyl Compounds with H<sub>2</sub> in Lewis Basic Solvents
Mojgan Heshmat, Timofei Privalov
The Journal of Physical Chemistry. A
|
May 30, 2018
Structurally Flexible Oxocarbenium/Borohydride Ion Pair: Dynamics of Hydride Transfer on the Background of Conformational Roaming
Mojgan Heshmat, Timofei Privalov
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
November 4, 2015
Ab Initio Molecular Dynamics with Explicit Solvent Reveals a Two-Step Pathway in the Frustrated Lewis Pair Reaction
Maoping Pu, Timofei Privalov
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
May 6, 2017
Carbonyl Activation by Borane Lewis Acid Complexation: Transition States of H<sub>2</sub> Splitting at the Activated Carbonyl Carbon Atom in a Lewis Basic Solvent and the Proton-Transfer Dynamics of the Boroalkoxide Intermediate
Mojgan Heshmat, Timofei Privalov
Khirurgiia
|
October 29, 1998
[Surgical management of acute cholecystitis in elderly and old age patients]
V A Privalov, V A Shramchenko, A E Gubnitskiĭ, et al.
The Journal of Chemical Physics
|
September 10, 2017
Testing the nature of reaction coordinate describing interaction of H<sub>2</sub> with carbonyl carbon, activated by Lewis acid complexation, and the Lewis basic solvent: A Born-Oppenheimer molecular dynamics study with explicit solvent
Mojgan Heshmat, Timofei Privalov
The Journal of Physical Chemistry. A
|
August 15, 2018
H<sub>2</sub> Cleavage by Frustrated Lewis Pairs Characterized by the Energy Decomposition Analysis of Transition States: An Alternative to the Electron Transfer and Electric Field Models
Mojgan Heshmat, Timofei Privalov
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
November 25, 2016
A Prediction of Proton-Catalyzed Hydrogenation of Ketones in Lewis Basic Solvent through Facile Splitting of Hydrogen Molecules
Mojgan Heshmat, Timofei Privalov
Occupational Health & Safety (Waco, Tex.)
|
November 8, 2005
Pixel-by-pixel prevention
George Privalov, Mac Mottley
Page
of 34
Search research articles
Search
Showing results (21-30 of 340) with videos related to
Sort By:
Page
of 34
The Journal of Chemical Physics
|
April 26, 2013
Ab initio dynamics trajectory study of the heterolytic cleavage of H2 by a Lewis acid [B(C6F5)3] and a Lewis base [P(tBu)3]
Maoping Pu, Timofei Privalov
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
July 6, 2017
Computational Elucidation of a Role That Brønsted Acidification of the Lewis Acid-Bound Water Might Play in the Hydrogenation of Carbonyl Compounds with H<sub>2</sub> in Lewis Basic Solvents
Mojgan Heshmat, Timofei Privalov
The Journal of Physical Chemistry. A
|
May 30, 2018
Structurally Flexible Oxocarbenium/Borohydride Ion Pair: Dynamics of Hydride Transfer on the Background of Conformational Roaming
Mojgan Heshmat, Timofei Privalov
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
November 4, 2015
Ab Initio Molecular Dynamics with Explicit Solvent Reveals a Two-Step Pathway in the Frustrated Lewis Pair Reaction
Maoping Pu, Timofei Privalov
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
May 6, 2017
Carbonyl Activation by Borane Lewis Acid Complexation: Transition States of H<sub>2</sub> Splitting at the Activated Carbonyl Carbon Atom in a Lewis Basic Solvent and the Proton-Transfer Dynamics of the Boroalkoxide Intermediate
Mojgan Heshmat, Timofei Privalov
Khirurgiia
|
October 29, 1998
[Surgical management of acute cholecystitis in elderly and old age patients]
V A Privalov, V A Shramchenko, A E Gubnitskiĭ, et al.
The Journal of Chemical Physics
|
September 10, 2017
Testing the nature of reaction coordinate describing interaction of H<sub>2</sub> with carbonyl carbon, activated by Lewis acid complexation, and the Lewis basic solvent: A Born-Oppenheimer molecular dynamics study with explicit solvent
Mojgan Heshmat, Timofei Privalov
The Journal of Physical Chemistry. A
|
August 15, 2018
H<sub>2</sub> Cleavage by Frustrated Lewis Pairs Characterized by the Energy Decomposition Analysis of Transition States: An Alternative to the Electron Transfer and Electric Field Models
Mojgan Heshmat, Timofei Privalov
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
November 25, 2016
A Prediction of Proton-Catalyzed Hydrogenation of Ketones in Lewis Basic Solvent through Facile Splitting of Hydrogen Molecules
Mojgan Heshmat, Timofei Privalov
Occupational Health & Safety (Waco, Tex.)
|
November 8, 2005
Pixel-by-pixel prevention
George Privalov, Mac Mottley
Page
of 34