Muguruma Chizuru

ムグルマチヅル | Muguruma Chizuru

Affiliation and department：
Job title： Professor

Research field (1)： Basic physical chemistry

Research keywords (8)：化学熱力学 , マルチカノニカル法 , 相転移 , 液体-固体 , water , argon , Liquid-Solid phase transition , Multicanonical method

Research theme for competitive and other funds (8)：

2010 - 2012 Molecular simulation studies of the liquid-liquid phase transition of low temperature and high-pressure water
2004 - 2006 分子シミュレーション法を用いた液体-固体相転移の研究
1998 - マルチカノニカル法による液体-固体相転移に関する理論的研究
分子軌道法
分子シミュレーション法

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Papers (15)：

Takuya Hayashi, Chizuru Muguruma, Yuko Okamoto. Calculation of the residual entropy of Ice Ih by Monte Carlo simulation with the combination of the replica-exchange Wang-Landau algorithm and multicanonical replica-exchange method. The Journal of Chemical Physics. 2021. 154. 4. 044503-044503
Bernd A. Berg, Chizuru Muguruma, Yuko Okamoto. Residual entropy of ordinary ice calculated from multicanonical Monte Carlo simulations. MOLECULAR SIMULATION. 2012. 38. 11. 856-860
Chizuru Muguruma, Yuko Okamoto, Bernd A. Berg. Thermodynamics of two lattice ice models in three dimensions. PHYSICAL REVIEW E. 2008. 78. 4
Chizuru Muguruma, Yuko Okamoto. Monte Carlo study of first-order phase transitions of a bulk Lennard-Jones fluid system in the isobaric-multithermal ensemble. Bulletin of the Chemical Society of Japan. 2008. 81. 6. 697-702
C. Muguruma, Y. Okamoto. Monte Carlo simulations in the isobaric-multithermal ensemble of a bulk Lennard-Jones fluid system: Thermodynamic quantities for pressure from P*=2.42 to 7.25. Phys. Rev. E. 2008. 77. 5,Pt.1. 051201

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MISC (2)：

六車千鶴. マルチカノニカルモンテカルロ法によるLennard-Jones流体の液体-固体相転移の研究. アンサンブル(分子シミュレーション研究会会誌). 2004. 6. 22-26
C Muguruma, Y Okamoto, M Mikami. Multicanonical Monte Carlo study of liquid-solid phase transition of argon. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY. 2002. 224. U498-U499

Lectures and oral presentations (36)：

Theoretical study on the reaction mechanism of 1,4-addition of 1,3,5-trimethoxybenzene to N-methylmaleimide
(The 103rd CSJ Annual Meeting (2023) 2023)
Elucidation of the reaction mechanism of 1,4-addition of 1,3,5-trimethoxybenzene to N-methylmaleimide by quantum chemical calculations
(The 16th Annual Meeting of the Japan Society for Molecular Science 2022)
MUCA MC法による部分的な制約付き3次元Isingモデルの相転移の研究
(日本物理学会第75回年次大会(2020) 2020)
マルチカノニカルMC法による水モデルおよびIsingモデルでの秩序-無秩序転移の研究
(第13回分子科学討論会2019名古屋 2019)
Multicanonical Monte Carlo Studies of second-order phase transition between water and ice VII, and those of Ising systems
(2019)

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Professional career (1)：

Work history (1)：

Awards (1)：

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