鈴木机倫 (Suzuki Kimichi) - マイポータル

基本情報

所属: 北海道大学化学反応創成研究拠点特任准教授

学位: 博士(理学)(横浜市立大学)

J-GLOBAL ID: 201801005953073099
researchmap会員ID: B000306131

研究分野

その他 / その他 /

論文

Efficient quantum mechanical minimum free energy path calculation by combining path integral hybrid Monte Carlo and climbing image nudged elastic band methods, and its application to the addition reaction of hydrogen isocyanide to formaldehyde

Aiko Io, Kimichi Suzuki, Makito Takagi, Masanori Tachikawa

The Journal of Chemical Physics 161(17) 2024年11月1日
Multistructural microiteration combined with QM/MM-ONIOM electrostatic embedding

Suzuki, Kimichi, Maeda, Satoshi

Physical Chemistry Chemical Physics 2022年
Reactivity prediction through quantum chemical calculations

Satoshi Maeda, Yu Harabuchi, Taisuke Hasegawa, Kimichi Suzuki, Tsuyoshi Mita

AsiaChem Magazine 2(1) 56-63 2021年12月31日
Chemoselective Cleavage of Si–C(sp3) Bonds in Unactivated Tetraalkylsilanes Using Iodine Tris(trifluoroacetate)

Keitaro Matsuoka, Narumi Komami, Masahiro Kojima, Tsuyoshi Mita, Kimichi Suzuki, Satoshi Maeda, Tatsuhiko Yoshino, Shigeki Matsunaga

Journal of the American Chemical Society 143(1) 103-108 2020年12月24日
Asymmetric remote C-H borylation of aliphatic amides and esters with a modular iridium catalyst

Ronald L. Reyes, Miyu Sato, Tomohiro Iwai, Kimichi Suzuki, Satoshi Maeda, Masaya Sawamura

SCIENCE 369(6506) 970-+ 2020年8月
Roles of Closed- and Open-Loop Conformations in Large-Scale Structural Transitions of l-Lactate Dehydrogenase

Suzuki Kimichi, Maeda Satoshi, Morokuma Keiji

ACS Omega 4(1) 1178-1184 2019年査読有り
Implementation and performance of the artificial force induced reaction method in the GRRM17 program

Satoshi Maeda, Yu Harabuchi, Makito Takagi, Kenichiro Saita, Kimichi Suzuki, Tomoya Ichino, Yosuke Sumiya, Kanami Sugiyama, Yuriko Ono

JOURNAL OF COMPUTATIONAL CHEMISTRY 39(4) 233-250 2018年2月査読有り
Nuclear Quantum Effect and H/D Isotope Effect on Hydrogen-Bonded Systems with Path Integral Simulation

Kimichi Suzuki, Yukio Kawashima, Masanori Tachikawa

Frontiers of Quantum Chemistry 377 2017年11月査読有り
Multistructural microiteration technique for geometry optimization and reaction path calculation in large systems

Kimichi Suzuki, Keiji Morokuma, Satoshi Maeda

JOURNAL OF COMPUTATIONAL CHEMISTRY 38(26) 2213-2221 2017年10月査読有り
Unusual H/D isotope effect in isomerization and keto-enol tautomerism reactions of pyruvic acid: nuclear quantum effect restricts some rotational isomerization reactions

Taro Udagawa, Keita Sugiura, Kimichi Suzuki, Masanori Tachikawa

RSC ADVANCES 7(15) 9328-9337 2017年査読有り
A multicomponent QM study of H-2 dissociation on small aluminum cluster

Taro Udagawa, Kimichi Suzuki, Masanori Tachikawa

INTERNATIONAL CONFERENCE ON COMPUTATIONAL SCIENCE (ICCS 2017) 108 2275-2281 2017年査読有り
Multicomponent Molecular Orbital-Climbing Image-Nudged Elastic Band Method to Analyze Chemical Reactions Including Nuclear Quantum Effect

Taro Udagawa, Kimichi Suzuki, Masanori Tachikawa

CHEMPHYSCHEM 16(15) 3156-3160 2015年10月査読有り
Experimental and Theoretical Studies of Hydrogen/Deuterium Spillover on Pt-Loaded Zeolite-Templated Carbon

Hirotomo Nishihara, Somlak Ittisanronnachai, Hiroyuki Itoi, Li-Xiang Li, Kimichi Suzuki, Umpei Nagashima, Hiroshi Ogawa, Takashi Kyotani, Masashi Ito

JOURNAL OF PHYSICAL CHEMISTRY C 118(18) 9551-9559 2014年5月査読有り
Path integral molecular dynamic study of nuclear quantum effect on small chloride water clusters of Cl-(H2O)(1-4)

Qi Wang, Kimichi Suzuki, Umpei Nagashima, Masanori Tachikawa, Shiwei Yan

CHEMICAL PHYSICS 419 229-236 2013年6月査読有り
Ab Initio Path Integral Simulations for the Fluoride Ion-Water Clusters: Competitive Nuclear Quantum Effect Between F--Water and Water-Water Hydrogen Bonds

Yukio Kawashima, Kimichi Suzuki, Masanori Tachikawa

JOURNAL OF PHYSICAL CHEMISTRY A 117(24) 5205-5210 2013年6月査読有り
Temperature dependence on the structure of Zundel cation and its isotopomers

Kimichi Suzuki, Masanori Tachikawa, Motoyuki Shiga

JOURNAL OF CHEMICAL PHYSICS 138(18) 2013年5月査読有り
Geometric isotope effects on small chloride ion water clusters with path integral molecular dynamics simulations

Qi Wang, Kimichi Suzuki, Umpei Nagashima, Masanori Tachikawa, Shiwei Yan

Chemical Physics 426 38-47 2013年査読有り
Ab Initio Path Integral Simulation of AgOH(H2O)

Akihito Koizumi, Kimichi Suzuki, Motoyuki Shiga, Masanori Tachikawa

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY 112(1) 136-139 2012年1月査読有り
Isotope effect of proton and deuteron adsorption site on zeolite-templated carbon using path integral molecular dynamics

Kimichi Suzuki, Masanori Tachikawa, Hiroshi Ogawa, Somlak Ittisanronnachai, Hirotomo Nishihara, Takashi Kyotani, Umpei Nagashima

THEORETICAL CHEMISTRY ACCOUNTS 130(4-6) 1039-1042 2011年12月査読有り
Path integral molecular dynamics for hydrogen adsorption site of zeolite-templated carbon with semi-empirical PM3 potential

Kimichi Suzuki, Megumi Kayanuma, Masanori Tachikawa, Hiroshi Ogawa, Hirotomo Nishihara, Takashi Kyotani, Umpei Nagashima

COMPUTATIONAL AND THEORETICAL CHEMISTRY 975(1-3) 128-133 2011年11月査読有り

もっとみる

MISC

A concerted mechanism between proton transfer of Zundel anion and displacement of counter cation (vol 134, 031101, 2011)

Akihito Koizumi, Kimichi Suzuki, Motoyuki Shiga, Masanori Tachikawa

JOURNAL OF CHEMICAL PHYSICS 134(16) 2011年4月

共同研究・競争的資金等の研究課題

反応中心自動更新法の開発と酵素反応への応用

日本学術振興会科学研究費助成事業基盤研究(C) 2021年4月 - 2024年3月

鈴木机倫, 宇田川太郎

鈴木机倫

基本情報

研究分野

論文

MISC

共同研究・競争的資金等の研究課題

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