List of works - Shigeyoshi Sakaki

Characterization of Rh-Al Bond in Rh(PAlP) (PAlP = Pincer-type Diphosphino-Aluminyl Ligand) in Comparison with Rh(L)(PMe3)2 (L = AlMe2, Al(NMe2)2, BR2, SiR3, CH3, Cl, or OCH3): Theoretical Insight

scientific article published on 04 April 2019

Control of local flexibility towards p-xylene sieving in Hofmann-type porous coordination polymers

scientific article published on 23 July 2020

Cooperative Bond Scission in a Soft Porous Crystal Enables Discriminatory Gate Opening for Ethylene over Ethane.

scientific article published on 13 November 2017

Coordination Flexibility of the Rh(PXP) Complex to NH3, CO, and C2H4 (PXP = Diphosphine-Based Pincer Ligand; X = B, Al, and Ga): Theoretical Insight

scientific article published on 15 October 2020

Correction to "The Suzuki-Miyaura Coupling of Nitroarenes"

scientific article published on 05 July 2018

Density Gradation of Open Metal Sites in the Mesospace of Porous Coordination Polymers.

scientific article published on 26 July 2017

Design and control of gas diffusion process in a nanoporous soft crystal

scientific article published on 01 January 2019

Electronic processes in NO dimerization on Ag and Cu clusters: DFT and MRMP2 studies

scientific article published on 31 October 2018

Experimental and Theoretical Investigation of an SN2-type Pathway for Borate-Fluorine Bond Cleavage by Electron-Rich Late-Transition Metal Complexes

scientific article published on 12 February 2020

Four-Electron Reduction of Dioxygen on a Metal Surface: Models of Dissociative and Associative Mechanisms in a Homogeneous System

scientific article published on 26 November 2020

How to Control Inversion vs Retention Transmetalation between PdII-Phenyl and CuI-Alkyl Complexes: Theoretical Insight

scientific article

Mo-Mo Quintuple Bond is Highly Reactive in H-H, C-H, and O-H σ-Bond Cleavages Because of the Polarized Electronic Structure in Transition State.

scientific article published on 14 March 2017

Pd/NHC-catalyzed cross-coupling reactions of nitroarenes

scientific article published on 24 July 2019

Propene oxidation catalysis and electronic structure of M55 particles (M = Pd or Rh): differences and similarities between Pd55 and Rh55

scientific article published on 26 March 2020

Reaction Behavior of the NO Molecule on the Surface of an Mn Particle (M = Ru, Rh, Pd, and Ag; n = 13 and 55): Theoretical Study of Its Dependence on Transition-Metal Element

scientific article published on 31 July 2019

Reactions of a Silylyne Complex with Aldehydes: Formation of W-Si-O-C Four-Membered Metallacycles and Their Metathesis-Like Fragmentation

scientific article published on 19 February 2019

Reversible π-system switching of thiophene-fused thiahexaphyrins by solvent and oxidation/reduction

scientific article published on 14 August 2018

Self-regeneration of a Ni-Cu alloy catalyst during a three-way catalytic reaction

scientific article published on 01 September 2019

The Suzuki-Miyaura Coupling of Nitroarenes

scientific article published on 5 July 2017

Theoretical Insight into Gate-Opening Adsorption Mechanism and Sigmoidal Adsorption Isotherm into Porous Coordination Polymer

scientific article published on 12 October 2018

Theoretical prediction of Ni(I)-catalyst for hydrosilylation of pyridine and quinoline

scientific article published on 11 June 2019

[2 + 2]-type Reaction of Metal-Metal σ-Bond with Fullerene Forming an η1-C60 Metal Complex: Mechanistic Details of Formation Reaction and Prediction of a New η1-C60 Metal Complex

scientific article published on 11 May 2017

sp3 C-H Borylation Catalyzed by Iridium(III) Triboryl Complex: Comprehensive Theoretical Study of Reactivity, Regioselectivity, and Prediction of Excellent Ligand

scientific article published on 17 June 2019

List of works by Shigeyoshi Sakaki