Publication List, Yoshinori Tamai

Publications in Refereed Journals

    pre-1994

  1. Determination by 1H and 13C NMR of Stereochemical Compositions of Oligo- and Poly(methyl methacrylate)s.
    T. Konishi, Y. Tamai, M. Fujii, Y. Einaga, H. Yamakawa, Polym. J. 21, 329-340 (1989).
  2. Mean-Square Radius of Gyration of Oligo- and Poly(methyl methacrylate)s in Dilute Solutions.
    Y. Tamai, T. Konishi, Y. Einaga, Y. Fujii, H. Yamakawa, Macromolecules, 23, 4067-4075 (1990).
  3. Intrinsic Viscosity of Oligo- and Poly(methyl methacrylate)s.
    Y. Fujii, Y. Tamai, T. Konishi, H. Yamakawa, Macromolecules, 24, 1608-1614 (1991).

    1994

  4. Molecular Simulation of Permeation of Small Penetrants through Membranes. 1. Diffusion coefficients.
     Y. Tamai, H. Tanaka, K. Nakanishi, Macromolecules, 27, 4498-4508 (1994).

    1995

  5. Molecular Simulation of Permeation of Small Penetrants through Membranes. 2. Solubilities.
     Y. Tamai, H. Tanaka, K. Nakanishi, Macromolecules, 28, 2544-2554 (1995).
  6. Molecular Design of Polymer Membranes using Molecular Simulation Technique.
     Y. Tamai, H. Tanaka, K. Nakanishi, Fluid Phase Equilibria, 104, 363-374 (1995).

    1996

  7. Molecular Dynamics Study of Water in Hydrogels.
     Y. Tamai, H. Tanaka, K. Nakanishi, Molecular Simulation, 16, 359-374 (1996).
  8. Molecular Dynamics Study of Polymer-Water Interaction in Hydrogels. 1. Hydrogen-bond Structure.
     Y. Tamai, H. Tanaka, K. Nakanishi, Macromolecules, 29, 6750-6760 (1996).
  9. Molecular Dynamics Study of Polymer-Water Interaction in Hydrogels. 2. Hydrogen-bond Dynamics.
     Y. Tamai, H. Tanaka, K. Nakanishi, Macromolecules, 29, 6761-6769 (1996).

    1997

  10. Large Thermal Expansivity of Clathrate Hydrates.
     H. Tanaka, Y. Tamai, K. Koga, J. Phys. Chem. B 101, 6560-6565 (1997).

    1998

  11. Permeation of Small Penetrants in Hydrogels.
     Y. Tamai, H. Tanaka, Fluid Phase Equilibria, 144, 441-448 (1998).
  12. Structure and Potential Surface of Liquid Methanol in Low Temperature: A Comparison of Hydrogen Bond Network in Methanol with Water.
     T. Kabeya, Y. Tamai, H. Tanaka, J. Phys. Chem. B 102, 899-905 (1998).
  13. Dynamic Properties of Supercooled Water in Poly(Vinyl Alcohol) Hydrogel.
     Y. Tamai, H. Tanaka, Chem. Phys. Lett. 285, 127-132 (1998).

    1999

  14. Structure and Dynamics of Poly(Vinyl Alcohol) Hydrogel.
     Y. Tamai, H. Tanaka, Molecular Simulation, 21, 283-301 (1999).
  15. Molecular Dynamics Simulation of Permanent Densification of Fluorozirconate Glass.
     Y. Tamai, Y. Kawamoto, Chem. Phys. Lett. 302, 15-19 (1999).
  16. Effects of Polymer Chains on Structure and Dynamics of Supercooled Water in Poly(Vinyl Alcohol).
     Y. Tamai, H. Tanaka, Phys. Rev. E 59, 5647-5654 (1999).

    2000

  17. Role of Structural Relaxation in Peculiar Permanent Densification of Fluorozirconate Glass.
     Y. Tamai, Y. Kawamoto, J. Chem. Phys. 112, 3875-3883 (2000).
  18. Structural Change in the Process of Permanent Densification of Fluorozirconate Glass studied with Molecular Dynamics Simulations.
     Y. Tamai, Y. Kawamoto, Phys. Rev. B 62, 865-873 (2000).

    2002

  19. A practice method to determine glass transition temperature in molecular dynamics simulation of mixed ionic glasses.
     Y. Tamai, Chem. Phys. Let. 351, 99-104 (2002).
  20. Molecular dynamics simulation of high-pressure densification of fluorozirconate glass.
     Y. Tamai, Y. Kawamoto, J. Non-Cryst. Solids 306, 282-291 (2002).
  21. Effects of Charge Transfer on a-SiO2 Surface Structure: A Molecular Dynamics Study
    C. Wang, N. Kuzuu, Y. Tamai, J. Appl. Phys. 92, 4408-4413 (2002).
  22. Thermally Induced Phase Transition of Crystalline Syndiotactic Polystyrene Studied by Molecular Dynamics Simulation.
    Y. Tamai, M. Fukuda, Macromol. Rapid Commun. 23, 891-895 (2002).

    2003

  23. Effects of Pressure on Fragile Nature of Fluorozirconates Studied by Molecular Dynamics Simulation.
    Y. Tamai, Phys. Rev. E 67, 031504-1-9 (2003).
  24. Fast One-Dimensional Gas Transport in Molecular Capillary Embedded in Polymer Crystal.
    Y. Tamai, M. Fukuda, Chem. Phys. Lett. 371, 217-222 (2003).
  25. Reorientational Dynamics of Aromatic Molecules Clathrated in δ Form of Crystalline Syndiotactic Polystyrene.
    Y. Tamai, M. Fukuda, Chem. Phys. Lett. 371, 620-625 (2003).
  26. Molecular Dynamics Study on Surface Structure of a-SiO2 by Charge Equilibration Method
    C. Wang, N. Kuzuu, Y. Tamai, J. Non-Cryst. Solids 318, 131-141 (2003).
  27. Nanoscale Molecular Cavity in Crystalline Polymer Membranes Studied by Molecular Dynamics Simulation.
    Y. Tamai, M. Fukuda, Polymer, 44, 3279-3289 (2003).
  28. Molecular Dynamics Study on Vibration Spectra of a-SiO2 Surface
    C. Wang, N. Kuzuu, Y. Tamai, J. Non-Cryst. Solids 321 , 204-209 (2003).
  29. Internal Rotation Barriers of Phenyl Ring in the Rigid-rod Polyimide Using ab initio Calculations
    M. Fukuda, Y. Takao, H. Kikuchi, Y. Tamai, ITE Lett. on Batteries, New Technologies & Medicine, 4, 193-197 (2003).
  30. Molecular Design of a Novel Ring Polyimide with Nanoscale Cavity Using ab initio Calculations
    M. Fukuda, Y. Takao, Y. Tamai, ITE Lett. on Batteries, New Technologies & Medicine, 4, 318-323 (2003).
  31. Nanoscale Cylindrical Cavity Formed by Stacking Ring Polyimide Molecules: A Molecular Dynamics Simulation
    M. Fukuda, Y. Tamai, ITE Lett. on Batteries, New Technologies & Medicine, 4, 456-460 (2003).
  32. Molecular Design of a Novel Ring Polyimide Based on BPDA-MDA Using Density Functional Theory
    M. Fukuda, Y. Takao, Y. Tamai, ITE Lett. on Batteries, New Technologies & Medicine, 4, 621-627 (2003).
  33. Intermolecular Interaction between the Aromatic Polyimide Chains Analyzed by DFT and ab initio Calculations
    M. Fukuda, Y. Takao, Y. Tamai, ITE Lett. on Batteries, New Technologies & Medicine, 4, 778-782 (2003).

    2004

  34. Construction of Layerd Structure of Rigid-Rod Polyesters with Flexible Side Chains by a Molecular Dynamics Simulation
    M. Fukuda, Y. Tamai, S. Kuwajima, J. Comput. Chem. Jpn. 3, 13-20 (2004).
  35. Molecular Dynamics Study of Temperature Dependence of Volume of Amorphous Silica
    N. Kuzuu, H. Yoshie, Y. Tamai, C. Wang, J. Non-Cryst. Solids, 349, 319-330 (2004).
  36. Effect of Encaged Aromatic Guests on the Shape and Connectivity of Molecular Cavity in Crystalline Polystyrene Evaluated by Molecular Simulations
    Y. Tamai, M. Fukuda, J. Chem. Phys. 121, 12085-12093 (2004).
  37. Sorption and Diffusion in Nanoscale Molecular Cavity in Polymer Crystals Studied by Molecular Dynamics Simulation
    Y. Tamai, M. Fukuda, Trans. Mater. Res. Soc. Jpn. 29, 3759-3762 (2004).
  38. Molecular Design of a Novel Ring Polyimide with Nanoscale Cavity Using DFT Calculations
    M. Fukuda, Y. Tamai, Trans. Mater. Res. Soc. Jpn. 29, 3703-3706 (2004).
  39. Sorption Mechanism of Aromatic Molecules in the Interface between Liquid and Polymer Crystal
    Y. Tamai, M. Fukuda, Mol. Simul. 30, 901-906 (2004).

    2005

  40. Sorption of Organic Solvents on the Surface of Crystalline Syndiotactic Polystyrene Studied by Molecular Dynamics Simulation
    Y. Tamai, M. Fukuda, J. Mol. Struct. 739, 27-32 (2005).
  41. Reorientational Relaxation of Aromatic Molecules in the Molecular Cavity of Crystalline Syndiotactic Polystyrene Studied by Molecular Dynamics Simulation
    Y. Tamai, Y. Tsujita, M. Fukuda, J. Mol. Struct. 739, 33-40 (2005).
  42. Formation of a 6FDA-based Ring Polyimide with Nanoscale Cavity Evaluated by DFT Calculations
    M. Fukuda, Y. Takao, Y. Tamai, J. Mol. Struct. 739, 105-115 (2005).
  43. Molecular Dynamic Study on Structure of Interface Formed by Binding Flat Amorphous Silica Surfaces at High Temperatures
    N. Kuzuu, K. Nagai, M. Tanaka, Y. Tamai, Jpn. J. Appl. Phys. 44, 7539-7545 (2005).
  44. Molecular Dynamics Study of Fictive Temperature Dependence of Density of Vitreous Silica
    N. Kuzuu, K. Nagai, M. Tanaka, Y. Tamai, Jpn. J. Appl. Phys. 44, 7550-7551 (2005).
  45. Molecular Dynamics Study on Compressibility of Vitreous Silica
    N. Kuzuu, K. Nagai, M. Tanaka, Y. Tamai, Jpn. J. Appl. Phys. 44, 8086-8087 (2005).

Other Publications (Japanese etc.)

  1. 計算化学的手法による機能性分離膜の設計
    Y. Tamai, K. Nakanishi, Kagaku, 48, 726-727 (1993).
  2. Effects of Chain Dynamics on Structure of Water in Hydrogels
    Y. Tamai, Bussei Kenkyu, 70, 80-81 (1998).
  3. クラスターマシンの設定と管理
    Y. Tamai, NETWORK, 16, 4-8 (2002).
  4. 高分子の分子動力学シミュレーション --高分子凝集体と低分子の相互作用を中心として--
    Molecular Dynamics Simulation of Polymers --Interaction between Polymer and Small Molecules--
    M. Fukuda, Y. Tamai, Kobunshi/High Polymers, Jpn. 53, 258-262 (2004).
  5. シミュレーションによるシンジオタクチックポリスチレンγ型結晶の構造決定
    Y. Tamai, M. Fukuda, Kobunshi Kako, 53, 230-235 (2004).
  6. 基礎講座＜分子シミュレーションの基礎と応用＞ 分子動力学法 III －材料設計への応用－
    玉井良則, 応用物理, 75, 1145-1148 (2006).
Copyright (c) 2000-2006 Yoshinori Tamai