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The Journal of Physical Chemistry. A
|
July 13, 2006
Global mapping of equilibrium and transition structures on potential energy surfaces by the scaled hypersphere search method: applications to ab initio surfaces of formaldehyde and propyne molecules
Satoshi Maeda, Koichi Ohno
Molecular Informatics
|
October 18, 2021
A Dataset of Computational Reaction Barriers for the Claisen Rearrangement: Chemical and Numerical Analysis
Hiroaki Okada, Satoshi Maeda
ACS Omega
|
August 4, 2020
Global Search for Crystal Structures of Carbon under High Pressure
Makito Takagi, Satoshi Maeda
Journal of Chemical Theory and Computation
|
November 25, 2015
Toward Predicting Full Catalytic Cycle Using Automatic Reaction Path Search Method: A Case Study on HCo(CO)3-Catalyzed Hydroformylation
Satoshi Maeda, Keiji Morokuma
The Journal of Chemical Physics
|
July 2, 2010
Communications: A systematic method for locating transition structures of A+B-->X type reactions
Satoshi Maeda, Keiji Morokuma
Journal of Chemical Theory and Computation
|
March 13, 2019
On Benchmarking of Automated Methods for Performing Exhaustive Reaction Path Search
Satoshi Maeda, Yu Harabuchi
The Journal of Physical Chemistry. A
|
April 28, 2007
Structures of water octamers (H2O)8: exploration on ab initio potential energy surfaces by the scaled hypersphere search method
Satoshi Maeda, Koichi Ohno
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
April 18, 2018
Designing the Backbone of Hexasilabenzene Derivatives with a High Unimolecular Kinetic Stability
Yosuke Sumiya, Satoshi Maeda
Physical Chemistry Chemical Physics : PCCP
|
July 1, 2022
Multistructural microiteration combined with QM/MM-ONIOM electrostatic embedding
Kimichi Suzuki, Satoshi Maeda
Journal of the American Chemical Society
|
December 5, 2008
Lowest transition state for the chirality-determining step in Ru((R)-BINAP)-catalyzed asymmetric hydrogenation of methyl-3-oxobutanoate
Satoshi Maeda, Koichi Ohno
Page
of 25
Search research articles
Search
Showing results (1-10 of 248) with videos related to
Sort By:
Page
of 25
The Journal of Physical Chemistry. A
|
July 13, 2006
Global mapping of equilibrium and transition structures on potential energy surfaces by the scaled hypersphere search method: applications to ab initio surfaces of formaldehyde and propyne molecules
Satoshi Maeda, Koichi Ohno
Molecular Informatics
|
October 18, 2021
A Dataset of Computational Reaction Barriers for the Claisen Rearrangement: Chemical and Numerical Analysis
Hiroaki Okada, Satoshi Maeda
ACS Omega
|
August 4, 2020
Global Search for Crystal Structures of Carbon under High Pressure
Makito Takagi, Satoshi Maeda
Journal of Chemical Theory and Computation
|
November 25, 2015
Toward Predicting Full Catalytic Cycle Using Automatic Reaction Path Search Method: A Case Study on HCo(CO)3-Catalyzed Hydroformylation
Satoshi Maeda, Keiji Morokuma
The Journal of Chemical Physics
|
July 2, 2010
Communications: A systematic method for locating transition structures of A+B-->X type reactions
Satoshi Maeda, Keiji Morokuma
Journal of Chemical Theory and Computation
|
March 13, 2019
On Benchmarking of Automated Methods for Performing Exhaustive Reaction Path Search
Satoshi Maeda, Yu Harabuchi
The Journal of Physical Chemistry. A
|
April 28, 2007
Structures of water octamers (H2O)8: exploration on ab initio potential energy surfaces by the scaled hypersphere search method
Satoshi Maeda, Koichi Ohno
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
April 18, 2018
Designing the Backbone of Hexasilabenzene Derivatives with a High Unimolecular Kinetic Stability
Yosuke Sumiya, Satoshi Maeda
Physical Chemistry Chemical Physics : PCCP
|
July 1, 2022
Multistructural microiteration combined with QM/MM-ONIOM electrostatic embedding
Kimichi Suzuki, Satoshi Maeda
Journal of the American Chemical Society
|
December 5, 2008
Lowest transition state for the chirality-determining step in Ru((R)-BINAP)-catalyzed asymmetric hydrogenation of methyl-3-oxobutanoate
Satoshi Maeda, Koichi Ohno
Page
of 25