Rchr
J-GLOBAL ID:201701011382718553
Update date: Aug. 09, 2024
Yokogawa Daisuke
ヨコガワ ダイスケ | Yokogawa Daisuke
Affiliation and department:
Research field (1):
Basic physical chemistry
Research keywords (2):
Quantum chemistry
, Solvation theory
Research theme for competitive and other funds (8):
- 2023 - 2028 ラジカル生成過程の観測と追跡を可能とする高精度電子状態理論の開発
- 2021 - 2024 化学的知見を生かした転送性の高い特徴量の抽出と利用
- 2019 - 2022 Theoretical study of the correlation between chemical reaction and intramolecular energy transfer through vibronic motions
- 2016 - 2021 Novel Energy and Information Conversions, Created by Solid-State Electrochemical Processes
- 2015 - 2018 Theoretical study on radiative and non-radiative decay passways in solution
- 2012 - 2015 Theoretical study of chemical reactions in ionic liquids based on quantum chemistry and statistical mechanics
- 2009 - 2012 NMR緩和分散法と理論化学計算に基づいた蛋白質遷移状態の構造決定法の開発
- 2006 - 2009 溶媒効果を取り込んだ金属錯体の電子状態に関する理論的研究
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Papers (103):
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Roberto Nolla-Saltiel, Zachary T Ariki, Stefanie Schiele, Jana Alpin, Yasuyo Tahara, Daisuke Yokogawa, Masakazu Nambo, Cathleen M Crudden. Enantiospecific cross-coupling of cyclic alkyl sulfones. Nature chemistry. 2024
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Kosuke Imamura, Daisuke Yokogawa, Hirofumi Sato. Spin-Spin Coupling Constant Based on Reference Interaction Site Model Self-Consistent Field with Constrained Spatial Electron Density. The journal of physical chemistry letters. 2024. 15. 29. 7473-7481
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Kayo Suda, Daisuke Yokogawa. Vibrational Self-Consistent Field (VSCF) and Post-VSCF Method Calculations Combined with the Reference Interaction Site Model Self-Consistent Field Method Coupled with the Constrained Spatial Electron Density Distribution: Applications to NaHCOO in Aqueous Phase. Journal of Chemical Theory and Computation. 2024. 20. 11. 4885-4892
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Hiroki Umeda, Kayo Suda, Daisuke Yokogawa, Yuto Azumaya, Nobuo Kitada, Shojiro A. Maki, Shigehiro A. Kawashima, Harunobu Mitsunuma, Yuki Yamanashi, Motomu Kanai. Unimolecular Chemiexcited Oxygenation of Pathogenic Amyloids. Angewandte Chemie International Edition. 2024. e202405605
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Naoki Negishi, Daisuke Yokogawa. Lagrangian of extended multiconfigurational self-consistent field second-order quasidegenerate perturbation theory combined with reference interaction site model self-consistent field constraint spatial electron density. The Journal of chemical physics. 2024. 160. 11
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Professional career (1):
Work history (3):
- 2018/09 - 現在 The University of Tokyo Graduate School of Arts and Sciences
- 2013/08 - 2018/08 Nagoya University Institute of Transformative Bio-Molecules
- 2011/10 - 2013/07 Nagoya University Graduate School of Science, Division of Material Science
Committee career (1):
- 2019/04 - 2022/03 日本化学会 化教誌編集委員
Awards (7):
- 2019 - 文部科学大臣表彰若手科学者賞 溶液内化学現象の微視的理解を目指した理論開発と応用研究
- 2018 - 日本化学会 第67回進歩賞 溶液内の化学事象の微視的理解を目指した統計力学と量子化学に基づく古典・量子ハイブリッド法の開発
- 2017 - 理論化学会 第20回理論化学研究会 優秀講演賞 溶媒和を考慮した量子化学計算における高精度な自由エネルギー算出を目指して
- 2012 - 溶液化学研究会 第6回溶液化学研究会奨励賞 量子化学・統計力学を融合させたマルチスケールな理論の開発と溶液化学における応用
- 2007 - 分子科学会 平成19年度分子科学会優秀講演賞 溶媒和積分方程式理論の並列化計算 ~生体分子への適用~
- 2007 - 日本化学会 第87春季年会学生講演賞 溶媒和における新規積分方程式理論の開発
- 2005 - 溶液化学研究会 第28回溶液化学シンポジウム・ポスター賞 動径分布関数から3次元分布関数を構築する新たな方法の開発
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