HOME >> About Us

Honours & Awards

Kosuke Imamura

Best Presentation Award at “The 25th Annual Meeting of the Japanese Association of Theoretical Chemists”

“Construction of parameter-free complex absorbing potential based on self-energy”

Kosuke Imamura

第44回溶液化学シンポジウム「ポスター賞」

「化学シフトに対する顕著な溶媒依存性を再現可能なGIAO-RISM-SCF-cSED法の開発と適用」

Sunsuke Yabu

Best Poster Award at the 16th Annual Meeting, The Japan Society of Molecular Science (Yokohama, 2022)

Yuichi Tanaka

Best Presentation Award Supported by PCCP at “The 24th Annual Meeting of the Japanese Association of Theoretical Chemists”

“Calculation of dynamic dielectric constant at electrochemical interface by variable-voltage MD simulation”

Kaho Nakatani

第43回溶液化学シンポジウム「ポスター賞」

「ベンゼンのニトロ化反応における溶媒和とWheland中間体の価電子構造」

Kosuke Imamura

Best Poster Award at the 15th Annual Meeting, The Japan Society of Molecular Science (Sapporo, 2021)

Kaho Nakatani

Best Poster presentation Award at “The 23nd Annual Meeting of Japan Society of Theoretical Chemistry”

“Analysis of valence electronic structures and chemical bonds by second quantized operator of nonorthogonal orbital”

Ken Takahashi

Best Poster presentation Award at “The 23nd Annual Meeting of Japan Society of Theoretical Chemistry”

“Determination of reduction potential and molecular structure at the electrode-electrolyte interface by mean-field constant-voltage QM/MM method”

Tomoaki Yagi

Best presentation Award at “The on-line symposium, The Japan Association of Solution Chemistry (2020)”

“Development of Solvation Theory at Crystal Surfaces: A Site-Density Functional Approach”

Ken Takahashi

Web討論会優秀学生発表賞 at “ECSJ 2020 87th Spring Meeting”

“電子分極可能MDによる電極電解液界面電子移動の理論的研究”

Kosuke Imamura

Best Poster Award at the 13th Annual Meeting, The Japan Society of Molecular Science (Nagoya, 2019)

“Coarse-grained Modeling of Nanocube Self-assembly System and Clarification of the Reaction Process”

Jun Oshiki

The 10th International Conference of the Asian Consortium on Computational Materials Science (ACCMS-10) “Best flash talk presentation”

Tomoaki Yagi

Best Presentation Award at “The 22nd Annual Meeting of the Japanese Association of Theoretical Chemists”

“相互作用点モデルに基づいた分子性液体の古典密度汎関数理論の定式化と自由エネルギー表式”

Yuichiro Yoshida

Best Poster presentation Award at “The 22nd Annual Meeting of the Japanese Association of Theoretical Chemists”

“Energy landscapes for complexes of a cyclic peptide and an ion”

Kento Kosugi

Poster Prize, Joint Conference of EMLG/JMLG (European/ Japanese Molecular Liquids Group) Meeting 2018

“Development of the DFTB/MM-RPMD method to study proton transfer reactions in solution”

Kento Kosugi

Best Presentation Award at the 12nd Annual Meeting, The Japan Society of Molecular Science (Fukuoka, 2018)

“Free Energy Calculation of a Proton Transfer Reaction in Solution by Using the DFTB/MM-RPMD Method”

Yuichiro Yoshida

Poster Presentation Award at “The 5th International Symposium on Dynamical Ordering of Biomolecular Systems for Creation of Integrated Functions” (Tokyo, 2017)

“A Model Hamiltonian to Evalute the Stability of MnL2n Coordination Polyhedra”

Wataru Ota

Poster Presentation Award at “The 6th CSJ Festa”(Tokyo, 2016)

“Theoretical Study of Graphite Intercalation Compounds in Li, Na and K-ion Batteries”

Yuichiro Yoshida

Best Poster Award at “The 4th International Conference on Molecular Simulation”(Shanghai, 2016)

“Potential energy landscapes of tetragonal pyramid molecules”

Kento Kasahara

Best Presentation Award at the 10th Annual Meeting, The Japan Society of Molecular Science (Kobe, 2016)

“A theory of diffusion controlled reactions in polyatomic molecule system”

Kento Kasahara

Best Presentation Award Supported by PCCP at “The 19th Annual Meeting of the Japanese Association of Theoretical Chemists”

“A theory of diffusion controlled reactions in polyatomic molecule system”

Yuichiro Yoshida

Poster Presentation Award at “The 4th International Symposium on Dynamical Ordering of Biomolecular Systems for Creation of Integrated Functions” (Fukuoka, 2015)

“Estimating structural stability of self-assembled clusters”

Yoshihiro Matsumura

Best Poster Award at the 7th Annual Meeting, The Japan Society of Molecular Science (Kyoto, 2013)

「溶液中における直鎖状分子の構造揺らぎのための積分方程式理論」

Kento Kasahara

第36回溶液化学シンポジウム(札幌、2013年)「ポスター賞」

「SSSV 方程式の三次元化および電解質溶液への適用」

Seigo Hayaki

52nd Sanibel Symposium Superior Poster Award (2012)

“An ab initio study on an excited-state intramolecular proton transfer reaction in ionic liquids”

Seigo Hayaki

Best Poster Award at the 5th Annual Meeting, The Japan Society of Molecular Science (Sapporo, 2011)

「イオン液体中における分子内プロトン移動反応に関する理論的研究」

Hideo Ando

51st Sanibel Symposium Superior Poster Award (2011)

“Wavepacket Dynamics Study on Ultrafast Intersystem Crossing of CrIII(acac)3

Kenji Iida

Best Poster Award at the 4th Annual Meeting, The Japan Society of Molecular Science (Osaka, 2010)

「積分方程式理論を用いた固液界面の理論的研究 ~2D Polymer RISM方程式の導出と応用~」

Kentaro Kido

Best Poster Award at the 4th Annual Meeting, The Japan Society of Molecular Science (Osaka, 2010)

「cucurbiturilのカチオン捕獲に関する分子論的研究:統計力学と量子化学によるアプローチ」

Kenji Iida

第32回溶液化学シンポジウム「ポスター賞」

「単原子電解質水溶液の並進エントロピーの濃度依存性における水の役割」

Kenji Hirano

Best Poster Award at the 3rd Annual Meeting, The Japan Society of Molecular Science (Nagoya, 2009)

「3次元溶媒和構造の解析法の開発とBacteriorhodopsinへの応用」

Takashi Hosoya

第59回日本木材学会大会優秀ポスター賞

「電子状態計算によるセルロース熱分解におけるレボグルコサン生成機構の解明」

Kenji Iida

第31回溶液化学シンポジウム「ポスター賞」

「アミンによる二酸化炭素吸着についての理論的研究」

Ken Saito

Best Presentation Award at the 2nd Annual Meeting, The Japan Society of Molecular Science (Fukuoka, 2008)

「六配位八面体型錯体の Laporte禁制 d-d遷移 : 振動子強度の理論的評価」

Seigo Hayaki

Best Poster Award at the 2nd Annual Meeting, The Japan Society of Molecular Science (Fukuoka, 2008)

「RISM-SCF法に基づく金属錯体の反応における溶媒効果に関する理論的研究‐白金(II)錯体の酸化的付加反応を例に‐」

Naoki Nakatani

48th Sanibel Symposiumでポスター賞(Graduate Student)

“Dioxygen Activation Mechanism in Fe3+ Catechol Dioxygenase: Importance of Multi-Configurational Character”

Atsushi Ikeda

Best Presentation Award at the 1st Annual Meeting, The Japan Society of Molecular Science (Sendai, 2007)

「分子集団における化学結合の性質:新しい共鳴理論の視点から」

Daisuke Yokogawa

Best Presentation Award at the 1st Annual Meeting, The Japan Society of Molecular Science (Sendai, 2007)

「溶媒和積分方程式理論の並列化計算 〜生体分子への適用〜」

Kentaro Kido

Best Presentation Award at the 1st Annual Meeting, The Japan Society of Molecular Science (Sendai, 2007)

「RISM理論に基づくpH効果の分子論的な解析法の開発」

Hideo Ando

Best Poster Award at the 1st Annual Meeting, The Japan Society of Molecular Science (Sendai, 2007)

「六配位鉄(II)錯体の光誘起スピン転移に関する理論的研究」

Daisuke Yokogawa

The Chemical Society of Japan Student Presentation Award 2007

「溶媒和における新規積分方程式理論の開発」

Daisuke Yokogawa

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」

Alumni(Ph.D)