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出版論文

出版論文

2020.11.19
    1. 分野別出版論文
        1. ノンコリニアー磁性の第一原理分子動力学
        2. 液体酸素の第一原理分子動力学
        3. 磁性クラスターの原子構造、磁気構造、電子状態
        4. 生体分子クラスターの電子状態と磁性
        5. タイトバインディング分子動力学法の開発
        6. 分子動力学・クラスター
        7. 超高圧下の第一原理的研究
        8. 固体物性
        9. 磁気異方性
        10. 表面電子状態
        11. カーボン系物質
        12. ファン・デル・ワールス‐スピン密度汎関数法
        13. 第一原理的対数関数平均動力学法 (第一原理的自由エネルギー計算手法開発）
        14. 高圧下における圧力誘起構造相転移と進化論的アルゴリズムを用いた物質構造探索
        15. 強磁性形状記憶合金
        16. 外部印加磁場の第一原理的研究
    2. 年代別出版論文
        1. 2020年~
        2. 2010年代
        3. 2000年代
        4. 1990年代

分野別出版論文

ノンコリニアー磁性の第一原理分子動力学
  • T. Oda, A. Pasquarello and R. Car, Fully Unconstrained Approach to Noncollinear Magnetism: Application to Small Fe Clusters, Phys. Rev. Lett. 80 (1998) 3622-3625. DOI: http://dx.doi.org/10.1103/PhysRevLett.80.3622
  • T. Oda, Metallic Car-Parrinello Dynamics, J. Phys. Soc. Jpn., 71, (2002) 519-524. DOI: http://dx.doi.org/10.1143/JPSJ.71.519
  • S. Kawamoto, T. Oda and I. Hamada, Association Simulation by a Metallic Car-Parrinello Dynamics, Int. J. Quantum Chem., 91 (2003) 165-170. DOI: http://dx.doi.org/10.1002/qua.10454
  • T. Oda and A. Hosokawa, Fully Relativistic Two-Component-Spinor Approach in the Ultra-Soft-Pseudopotential Planewave Method, Phys. Rev. B, 72 (2005) 224428(1-4). DOI: http://dx.doi.org/10.1103/PhysRevB.72.224428
  • A. Hosokawa, M. Tsujikawa, H. Shiroishi and T. Oda, Development of Fully Relativistic Pseudopotentials and Application to a Thin Magnetic Film on the Metal, J. Magn. Magn. Mater., 310 (2007) 1637-1639. DOI: http://dx.doi.org/10.1016/j.jmmm.2006.10.491
  • 擬ポテンシャル法を用いた第一原理計算の計算コード開発および並列計算コード開発
  • 小田竜樹,「ノンコリニアー磁性の第一原理分子動力学と液体酸素 のシミュレーション」,日本物理学会誌,第60巻,第1号, (2005) 35-39.
  • Junpei Gotou, Shinya Haraguchi, Masahito Tsujikawa, Tatsuki Oda, Time benchmarks for the OpenMP and GPU parallelized calculation in the planewave pseudopotential density functional approach, Recent Development in Computational Science (ISSN 2223-0785), 2 (2011) 17-25.
液体酸素の第一原理分子動力学
  • Junpei Gotou, Shinya Haraguchi, Masahito Tsujikawa, Tatsuki Oda, Time benchmarks for the OpenMP and GPU parallelized calculation in the planewave pseudopotential density functional approach, Recent Development in Computational Science (ISSN 2223-0785), 2 (2011) 17-25.
  • T. Oda and A. Pasquarello, Structural and Magnetic Correlations in Liquid Oxygen : An Ab Initio Molecular Dynamics Study, J. Phys.: Condens. Matter, 15 (2003) S89-S94. DOI: http://dx.doi.org/10.1088/0953-8984/15/1/310
  • T. Oda and A. Pasquarello, Noncollinear Magnetism in Liquid Oxygen: A First-Principles Molecular Dynamics Study, Phys. Rev. B, 70 (2004) 134402(1-19). DOI: http://dx.doi.org/10.1103/PhysRevB.70.134402
磁性クラスターの原子構造、磁気構造、電子状態
  • T. Oda, Magnetic Excitation of Ferromagnetic Dimer Molecules, Euro. Phys. J. D., 16 (2001) 181-184.
  • N. Fujima and T. Oda, Non-collinear Magnetic Moment of Linear-Chain Fe Clusters, Trans. Mat. Res. Soc. Jpn., 27 (2002) 201-204.
  • H. Shiroishi, T. Oda, I. Hamada and N. Fujima ,Structure and Magnetism on Iron Oxide Clusters FenOm(n=1-5) : Calculation from First Principles, Eur. Phys. J. D, 24 (2003) 85-88. DOI: http://dx.doi.org/10.1140/epjd/e2003-00136-3
  • N. Fujima and T. Oda, Structure and Non-Collinear Magnetism of Iron Linear Chains, Eur. Phys. J. D., 24 (2003) 89-92. DOI: http://dx.doi.org/10.1140/epjd/e2003-00135-4
  • H. Shiroishi, T. Oda, I. Hamada and N. Fujima, Structure and Magnetism of Anion Iron Oxide Clusters FenOm(n=3,4), Polyhedron, 24 (2005) 2472-2476. DOI: http://dx.doi.org/10.1016/j.poly.2005.03.065
  • H. Shiroishi, T. Oda, I. Hamada and N. Fujima, Structure and Magnetism of Anion Iron Oxide Clusters FenOm(n=3,4), Polyhedron, 24 (2005) 2472-2476.
  • N. Fujima and T. Oda, Structure and Magnetic Properties of Iron Chains Encapsulated in Tubal Carbon Nano Capsules, Phys. Rev. B, 71 (2005) 115412(1-9). DOI: http://dx.doi.org/10.1103/PhysRevB.71.115412
  • H. Shiroishi, T. Oda and N. Fujima, Electronic Structure and Magnetism of Fe-Wire in Carbon Nanotubes, J. Magn. Magn. Mater., 310 (2007) 1640-1641.
  • H. Shiroishi, T. Oda, H. Sakashita and N. Fujima, Structure and Magnetism in Carbon Nanotubes Including Magnetic Wire, Eur. Phys. J. D., 143 (2007) 129-132.
  • N. Fujima and T. Oda, Bonding properties and structures of titanium clusters on (10, 0) single wall carbon nano capsule, Eur. Phys. J. D., 52 (2009) 87-90. DOI: http://dx.doi.org/10.1140/epjd/e2009-00066-0
生体分子クラスターの電子状態と磁性
  • T. Oda, H. Nagao, A. Sugiyama, and K. Wada, Electronic structure and magnetism at the active site in ferredoxin : ab initio approach to (Fe2S2)2+ complex with the 1st peptide shell, Polyhedron, 24 (2005) 2550-2556.DOI: http://dx.doi.org/10.1016/j.poly.2005.03.167
  • Naohiro Kitagawa, Masao Obata, Tatsuki Oda, Density functional study on positively charged six-coordinate FeO2 porphyrin complex for a trigger of O2 dissociation, Chemical Physics Letters 643 (2016) 119–125. DOI: 10.1016/j.cplett.2015.11.026
タイトバインディング分子動力学法の開発
  • F. Shimizu, H. Kaburagi, T. Oda and Y. Hiwatari, Chain Structure of Liquid and Amorphous Selenium : Tight-Binding Molecular-Dynamics Simulation, J. Non-Cryst. Solids, 250-252 (1999) 433-436.DOI: http://dx.doi.org/10.1016/S0022-3093(99)00337-3
  • T. Oda and Y. Hiwatari, Order-N Tight-Binding Molecular Dynamics Simulation with a Fermi Operator Expansion Approach : Application to a Liquid Carbons, J. Phys. : Condens. Matter , 12 (2000) 1627-1639. DOI: http://dx.doi.org/10.1088/0953-8984/12/8/305
  • T. Oda and Y. Hiwatari, Tight-Binding Molecular-Dynamics with the Fermi Operator Expansion : Application to Liquid Carbons, Prog. Theor. Phys., Suppl., 138 (2000) 124-125.
分子動力学・クラスター
  • S. Makino, T. Oda and Y. Hiwatari, Classical Molecular Dynamics for the Formation Process of a Fullerene Molecule, J. Phys. Chem. Solids, 58 (1997) 1845-1861.DOI: http://dx.doi.org/10.1016/S0022-3697(97)00093-0
  • T. Hasimoto, T. Oda and Y. Hiwatari, Structural Transformations of Ice at High Pressures via Molecular Dynamics Simulations II, Mol. Simul., 18 (1997) 395-406.DOI: http://dx.doi.org/10.1080/08927029708024133
  • K. Uehara, M. Ishitobi, T. Oda and Y. Hiwatari, First-Principles Molecular Dynamics Simulations of Selenium Clusters, Mol. Simul., 18 (1997) 385-394.DOI: http://dx.doi.org/10.1080/08927029708024132
  • K. Uehara, M. Ishitobi, T. Oda and Y. Hiwatari, First-Principles Molecular Dynamics Simulations for Se8 and Se8+ Clusters, Mol. Simul., 19 (1997) 75-84.DOI: http://dx.doi.org/10.1080/08927029708024140
  • K. Uehara, M. Ishitobi, T. Oda and Y. Hiwatari, First-Principles Molecular Dynamics Simulations of Selenium Clusters, Z. Phys. D, 40 (1997) 472-475.
  • K. Uehara, T. Oda, Y. Hiwatari and M. Ishitobi, First-Principles Molecular Dynamics Calculation of Selenium Clusters, Proceedings of the International Symposium, The Physics of Complex Liquids, ed. F. Yonezawa, K. Tsuji, K. Kaji, M. Doi, T. Fujiwara,(Singapore: World Scientific), (1998) p.144-152.
  • Yoshiaki Hashimoto, Masako Takasu, Shuhei Kawamoto, Tatsuki Oda, Hidemi Nagao, Takamasa Sakai and Ung-il Chung, Structure and dynamics of tetra-PEG gel by Brownian dynamics, Transactions of the Materials Research Society of Japan, 35 (2010) 547-553. http://u111u.info/kmu2
  • Shuhei Kawamoto, Masako Takasu, Takeshi Miyakawa, Ryota Morikawa, Tatsuki Oda, Shiroh Futaki and Hidemi Nagao, Inverted micelle formation of cell-penetrating peptide studied by coarse-grained simulation: Importance of attractive force between cell-penetrating peptides and lipid head group, J. Chem. Phys., 134 (2011), 095103(1-6). DOI: http://dx.doi.org/10.1063/1.3555531
  • Shuhei Kawamoto, Takeshi Miyakawa, Masako Takasu, Ryota Morikawa, Tatsuki Oda, Hiroaki Saito, Shiroh Futaki and Hidemi Nagao, Cell penetrating peptide induces various deformations of lipid bilayer membrane: inverted micelle, double bilayer and trans-membrane, International Journal of Quantum Chemistry, 112 (2012), 178-183. ( January 2012) DOI: http://dx.doi.org/10.1002/qua.23177
  • Shuhei Kawamoto, Masako Takasu, Takeshi Miyakawa, Ryota Morikawa, Tatsuki Oda, Shiroh Futakic, and Hidemi Nagao, Binding of Tat Peptides on DOPC and DOPG Lipid Bilayer Membrane Studied by Molecular Dynamics Simulations, Molecular Simulation, 38(5), (2012), 366-368.DOI: http://dx.doi.org/10.1080/08927022.2010.536546
超高圧下の第一原理的研究
  • M. Geshi, T. Oda and Y. Hiwatari, High Pressure Phases and the Structural Phase Transition of Selenium, J. Phys. Soc. Jpn., 67 (1998) 3141-3146.DOI: http://dx.doi.org/10.1143/JPSJ.67.3141
  • M. Geshi, T. Oda and Y. Hiwatari, The Electronic Structure of a High Pressure Monoclinic Selenium and the Structural Phase Transition, J. Phys. Soc. Jpn., 68 (1999) 3341-3346.DOI: http://dx.doi.org/10.1143/JPSJ.68.3341
  • M. Geshi, T. Oda and Y. Hiwatari, Electronic Structures and Phase Transitions of Selenium under High Pressure with FLAPW method, Prog. Theor. Phys., Suppl., 138 (2000) 249-250.
  • I. Hamada, T. Oda, and N. Suzuki, Theoretical Study on Pressure-Induced Structural Phase Transitions in Phosphorus, Science and Technology of High Pressure (Proceedings of AIRAPT-17), edited by M.H. Manghnani, W. J. Nellis and M. F. Nicol, (Universities Press, Hyderabad, India), 467-470, 2000.
  • M. Geshi, T. Oda and Y. Hiwatari, Electronic Structure and Structural Stability of the High-Pressured Orthorhombic Phase of Selenium, J. Phys. : Condens. Matter, 13 (2001) 9401-9410.DOI: http://dx.doi.org/10.1088/0953-8984/13/42/301
  • M. Geshi, T. Oda and Y.Hiwatari, Electronic Structure and Space Group of the Orthorhombic Selenium under High Pressure, J. Phys.: Condens. Matter, 14 (2002) 10885-10890. DOI: http://dx.doi.org/10.1088/0953-8984/14/44/395
  • T. Oda, K. Sugimori, H. Nagao, I. Hamada, S. Kagayama, M. Geshi, H. Nagara, K. Kusakabe and N. Suzuki, Oxygen at High Pressures : Theoretical Approach to Monoatomic Phases, J. Phys.: Condens. Matter, 19 (2007) 365211 (1-7). DOI: http://dx.doi.org/10.1088/0953-8984/19/36/365211
固体物性
  • T. Oda, M. Shirai, N.Suzuki and K. Motizuki, Role of Electron–phonon Interaction in Lattice Dynamics and Superconductivity of an Oxide Spinel LiTi2O4, J. Supercond., 7 (1994) 555-558.
  • T. Oda, M. Shirai, N.Suzuki and K. Motizuki, Electron-Phonon Interaction, Lattice Dynamics and Superconductivity of an Oxide Spinel LiTi2O4, J. Phys.: Condens. Matter, 6 (1994) 6997-7012.DOI: http://dx.doi.org/10.1088/0953-8984/6/35/009
  • T. Oda, M. Shirai, N.Suzuki and K. Motizuki, Electronic Band Structure of Sulphide Spinels CuM2S4 (M=Co, Rh, Ir), J. Phys.: Condens. Matter, 7 (1995) 4433-4445.DOI: http://dx.doi.org/10.1088/0953-8984/7/23/012
  • T. Oda, M. Shirai, N.Suzuki and K. Motizuki, First-Principles Study on Lattice Dynamics and Electron-Phonon Interaction in an Oxide Spinel LiTi2O4, Physica B, 219&220 (1996) 451-453.DOI: http://dx.doi.org/10.1016/0921-4526(95)00775-X
  • N. Suzuki, H. Sakamoto, T. Oda and M. Shirai, First-Principles Calculation of Lattice Dynamics and Electron-Phonon Interaction in Hight Pressure Phase of Solid Iodine”, Physica B, 219&220 (1996) 454-456.DOI: http://dx.doi.org/10.1016/0921-4526(96)00776-4
  • H. Sakamoto, T. Oda, M. Shirai and N. Suzuki, Application of Frozen–Phonon Method to Lattice Dynamics in Fcc Solid Iodine, J. Phys. Soc. Jpn., 65 (1996) 489-495.DOI: http://dx.doi.org/10.1143/JPSJ.65.489
  • T. Oda, M. Shirai, N. Suzuki and K. Motizuki, Full-Potential Calculation of Electronic Structure of Sulphide Spinels , Cryst. Res. Technol., 31 (1996) 877-880.
  • I. Hamada, T. Oda, N. Suzuki, and H. Katayama-Yoshida, Variational Density-Functional Perturbation Theory with Ultrasoft Pseudopotentials, J. Compt. Theor. Nano. ( Journal of Computational and Theoretical Nanoscience), 6 (2009) 2550-2558.DOI: http://dx.doi.org/10.1166/jctn.2009.1314
  • Masao Obata, Mega Christivana, and Tastuki Oda, Investigation of magnetic dipole-dipole interaction using magnetic density on solid oxygen based on first-principles approach, AIP Advances 8, 101419 (2018) DOI: https://doi.org/10.1063/1.5043062
磁気異方性
  • M. Tsujikawa, A. Hosokawa and T. Oda, Magnetic Anisotropies of Iron on the Low Index Platinum Surface, J. Magn. Magn. Mater., 310 (2007) 2189-2191. DOI: http://dx.doi.org/10.1016/j.jmmm.2006.10.754
  • M. Tsujikawa, A. Hosokawa and T. Oda, Magnetic Anisotropies of Iron on the Pt (111) Surface, J. Phys.: Condens. Matter, 19 (2007) 365208 (1-8); Erratum 19 (2007) 479002 (1-1). DOI: http://dx.doi.org/10.1088/0953-8984/19/36/365208
  • M. Tsujikawa, A. Hosokawa and T. Oda, Magnetic Anisotropy of Fe/Pt(001) and Pt/Fe/Pt(001) Using a First-Principles Approach, Phys. Rev. B, 77 (2008) 054413(1-10).DOI: http://dx.doi.org/10.1103/PhysRevB.77.054413
  • 小田竜樹，辻川雅人，「第一原理計算による表面磁気異方性計算」，表面科学，Vol. 29, No. 10 (2008) 637-641.
  • M. Tsujikawa and T. Oda, Electronic structure and magnetic anisotropy of a constrained Fe chain in electric field, J. Phys. : Condens. Matter, 21 (2009) 064213 (1-6).DOI: http://dx.doi.org/10.1088/0953-8984/21/6/064213
  • M. Tsujikawa and T. Oda, Finite electric field effects in the large perpendicular magnetic anisotropy surface Pt/Fe/Pt(001): a first principles study, Phys. Rev. Lett., 102 (2009) 247203(1-4). DOI: http://dx.doi.org/10.1103/PhysRevLett.102.247203
  • M. Tsujikawa, and T. Oda, Electronic Structure and Magnetic Anisotropy in Iron Chains from a First-Principles Study, J. Compt. Theor. Nano. ( Journal of Computational and Theoretical Nanoscience), 6 (2009) 2597-2602.DOI: http://dx.doi.org/10.1166/jctn.2009.1320
  • T. Oda, Y. Yokoo, H. Sakashita, and M. Tsujikawa, Magnetic Anisotropy in Small Clusters FePt, Fe2Pt, and FePt2 : from a First-Principles Study, J. Compt. Theor. Nano.( Journal of Computational and Theoretical Nanoscience), 6 (2009) 2603-2607.DOI: http://dx.doi.org/10.1166/jctn.2009.1321
  • Masahito Tsujikawa, Shinya Haraguchi, Tatsuki Oda, Yoshio Miura and Masafumi Shirai, A Comparative Ab Initio Study on Electric-Field Dependence of Magnetic Anisotropy in MgO/Fe/Pt and MgO/Fe/Au Films, J. Appl. Phys., 109 (2011) 07C107(1-3).DOI: http://dx.doi.org/10.1063/1.3540677
  • Shinya Haraguchi, Masahito Tsujikawa, Junpei Gotou, Tatsuki Oda, Electric-field effects on magnetic anisotropy in Pd/Fe/Pd(001) surface, J. Phys. D: Appl. Phys., 44 (2011) 064005(1-8).DOI: http://dx.doi.org/10.1088/0022-3727/44/6/064005
  • Masahito Tsujikawa, Shinya Haraguchi, and Tatsuki Oda, Effect of atomic monolayer insertions on electric-field-induced rotation of magnetic easy axis, J. Appl. Phys., 111 (2012) 083910(1-4).DOI: http://dx.doi.org/10.1063/1.3703682
  • Tetsuro Ueno, Masahiro Sawada, Kazuhito Furumoto, Tetsuro Tagashira, Satoshi Tohoda, Akio Kimura, Shinya Haraguchi, Masahito Tsujikawa, Tatsuki Oda, Hirofumi Namatame, and Masaki Tanigushi, Interface atomic structures and magnetic anisotropy of Fe and Pd/Fe monatomic films on Pd(001), Phys. Rev. B, 85 (2012) 224406(1-11).DOI: http://dx.doi.org/10.1103/PhysRevB.85.224406
  • D. Yoshikawa, M. Obata, Y. Taguchi, S. Haraguchi, and T. Oda, Possible origin of non-linear magnetic anisotropy variation in electric field effect in a double interface system, Applied Physics Express, 7 (2014) 113005(1-4).DOI: http://dx.doi.org/10.7567/APEX.7.113005
  • Daiki Yoshikawa, Masao Obata, and Tatsuki Oda, First-principles study on structural and electronic properties in Fe/MgO double interface, JPS Conference Proceedings 5, (2015) 011012 (1-7). DOI: http://dx.doi.org/10.7566/JPSCP.5.011012.
  • Mohamed Belmoubarik, Muftah Al-Mahdawi, Masao Obata, Daiki Yoshikawa, Hideyuki Sato, Tomohiro Nozaki, Tatsuki Oda, and Masashi Sahashi, Tunneling electroresistance of MgZnO-based tunnel junctions, Applied Physics Letters 109 (2016) 173507, accepted on 12 October 2016, published online on 26 October 2016. DOI: http://dx.doi.org/10.1063/1.4966180
  • Tatsuki Oda and Masao Obata, Implementation of magnetic dipole interaction in the planewave-basis approach for slab systems, J. Phys. Soc. Jpn.(Journal of the Physical Society of Japan), 87, 064803 (2018) [8 Pages], Published online on 25 May 2018, DOI: https://doi.org/10.7566/JPSJ.87.064803
  • Indra Pardede, Tomosato Kanagawa, Nurul Ikhsan, Itsuki Murata1, Daiki Yoshikawa, Masao Obata, and Tatsuki Oda, A comprehensive study of sign change in electric field control perpendicular magnetic anisotropy energy at Fe/MgO interface: first principles calculation, IEEE Transactions on Magnetics (IEEE Trans. Magn.), Volume: 55, Issue: 2, Print ISSN: 0018-9464, Online ISSN: 1941-0069, DOI: https://doi.org/10.1109/TMAG.2018.2860581
  • Tatsuki Oda, Indra Paradede, Tomosato Kanagawa, Nurul Ikhsan, Daiki Yoshikawa, and Masao Obata, Shape Magnetic Anisotropy from Spin Density in Nanoscale Slab Systems, IEEE Transactions on Magnetics, Accepted on 29 August 2018, DOI: https://doi.org/10.1109/TMAG.2018.2868843
  • Nurul Ikhsan, Indra Paradede, Tomosato Kanagawa, Daiki Yoshikawa, Masao Obata, and Tatsuki Oda, Fermi level smearing effect in the perpendicular interfac Fe/MgO magnetic anisotropy, accepted for publication to The Science Reports of Kanazawa University, Accepted on 28 August 2018.
  • Nurul Ikhsan, Tomosato Kanagawa, Indra Paradede, Daiki Yoshikawa, and Tatsuki Oda, Perpendicular and in-plane magnetic anisotropies in Cr-buffered Fe(x)/MgO interface from first-principles approach, accepted for publication to The Science Reports of Kanazawa University, Accepted on 23 August 2018.
  • Muftah Al-Mahdawi, Mohamed Belmoubarik, Masao Obata, Daiki Yoshikawa, Hideyuki Sato, Tomohiro Nozaki, Tatsuki Oda, and Masashi Sahashi, Large nonvolatile control of magnetic anisotropy in CoPt/ZnO magnetic tunnel junctions, Phys. Rev. B, 100, 054423 (2019), DOI: https://link.aps.org/doi/10.1103/PhysRevB.100.054423
  • Indra Pardede, Daiki Yoshikawa, Tomosato Kanagawa, Nurul Ikhsan, Itsuki Murata, Masao Obata, Tatsuki Oda, Anatomy of large perpendicular magnetic anisotropy in free-standing Co/Ni(111) multilayer, J. Magn. Magn. Mater., 500, 166357 (2020), DOI: https://doi.org/10.1016/j.jmmm.2019.166357
表面電子状態
  • K. Sakamoto, T. Oda, A. Kimura, K. Miyamoto, M. Tsujikawa, A. Imai, N. Ueno, H. Namatame, M. Taniguchi, P. E. J. Eriksson, and R. I. G. Uhrberg, Abrupt rotation the Rashba spin to the direction perpendicular to the surface, Phys. Rev. Lett., 102 (2009) 096805(1-4).DOI: http://dx.doi.org/10.1103/PhysRevLett.102.096805
  • A. Araki, T. Nishijima, M. Tsujikawa and T. Oda, Spin-splitting band dispersions of the heavy elements on Si (111)-(1×1) surface, J. Phys.: Conf. Ser.(Conference Series), 200 (2010) 062001(1-4).DOI: http://dx.doi.org/10.1088/1742-6596/200/6/062001
  • Kazuyuki Sakamoto, Tae-Hwan Kim, Takuya Kuzumaki, Beate Müller, Yuta Yamamoto, Minoru Ohtaka, Jacek Osiecki, Koji Miyamoto, Yasuo Takeichi, Ayumi Harasawa, Sebastian D. Stolwijk, Anke B. Schmidt, Jun Fujii, Roger I. G. Uhrberg, Markus Donath, Han Woong Yeom and Tatsuki Oda, Valley spin polarization by extraordinary Rashba spin on silicon, Nat. Commun., 4, 2073, http://dx.doi.org/10.1038/ncomms3073, (2013) (6 pages).
  • Kazuyuki Sakamoto, Tatsuki Oda, Akio Kimura, Yasuo Takeichi, Jun Fujii, R. I. G. Uhrberg, Markus Donath, Han Woong Yeom, Symmetry-induced peculiar Rashba effect on thallium adsorbed Si(111) surfaces, Journal of Electron Spectroscopy and Related Phenomena, in press, 2014. DOI: http://dx.doi.org/10.1016/j.elspec.2014.09.008)
  • Emilia Annese, Takuya Kuzumaki, Beate Müller, Yuta Yamamoto, Hiroto Nakano, Haruki Kato, Atsushi Araki, Minoru Ohtaka, Takashi Aoki, Hirotaka Ishikawa, Takashi Hayashida, Jacek R. Osiecki, Koji Miyamoto, Yasuo Takeichi, Ayumi Harasawa, Koichiro Yaji, Tetsuroh Shirasawa, Koh-ichi Nittoh, Woo Il Yang, Kazushi Miki, Tatsuki Oda, Han Woong Yeom, and Kazuyuki Sakamoto, Nonvortical Rashba spin structure on a surface with C1h symmetry, Phys. Rev. Lett., 117 (2016) 16803, published on 30 June 2016. DOI:　http://dx.doi.org/10.1103/PhysRevLett.117.016803
カーボン系物質
ファン・デル・ワールス‐スピン密度汎関数法
  • M. Obata, M. Nakamura, I. Hamada, and T. Oda, Implementation of van der Waals density functional approach to the spin polarized system: interaction potential between oxygen molecules, J. Phys. Soc. Jpn., 82 (2013) 093701(1-5).DOI: http://dx.doi.org/10.7566/JPSJ.82.093701
  • Masao Obata, Makoto Nakamura, Ikutaro Hamada, and Tatsuki Oda, Improving the Description of Nonmagnetic and Magnetic Molecular Crystals via the van der Waals Density Functional, J. Phys. Soc. Jpn., 84 (2015) 024715(1-9). DOI: http://dx.doi.org/10.7566/JPSJ.84.024715
  • Masao Obata, Ikutaro Hamada, and Tatsuki Oda, Molecular Interactions for Modeling of Oxygen System Using van der Waals Density Functional Approach, JPS Conference Proceedings 5, (2015) 011011(1-7). DOI: http://dx.doi.org/10.7566/JPSCP.5.011011.
  • Masao Obata, Ikutaro Hamada, and Tatsuki Oda, First principles study on solid oxygen using van der Waals density functional, Physics Procedia, 75 (2015) 771-778. The proceedings of ICM 2015(20th International Conference on Magnetism). DOI: http://dx.doi.org/10.1016/j.phpro.2015.12.100.
  • Mega Christivana, Masao Obata, and Tatsuki Oda, Noncollinear magnetic structure with spin- dependent van der Waals density functional approach: beta-phase solid oxygen, J. Phys. Soc. Jpn., 88, 104601 (2019),DOI: https://journals.jps.jp/doi/10.7566/JPSJ.88.104601.
第一原理的対数関数平均動力学法 (第一原理的自由エネルギー計算手法開発）
  • M. Nakamura, M. Obata, T. Morishita, and T. Oda, An ab initio approach to free-energy reconstruction using logarithmic mean force dynamics, J. Chem. Phys., 140 (2014) 184110(1-10).DOI: http://dx.doi.org/10.1063/1.4874654
高圧下における圧力誘起構造相転移と進化論的アルゴリズムを用いた物質構造探索
  • Athiya M. Hanna, Toru Yoshizaki, Muhamad A. Martoprawiro, Tatsuki Oda, High-pressure crystal structure prediction, using evolutionary algorithm simulation, Recent Development in Computational Science (ISSN 2223-0785), 2 (2011) 37-45.
  • T. Ishikawa, H. Nagara, T. Oda, N. Suzuki, and K. Shimizu, Phase with pressure-induced shuttlewise deformation in dense solid atomic hydrogen, Phys. Rev. B 90, (2014) 104102(1-6).DOI: http://dx.doi.org/10.1103/PhysRevB.90.104102.
  • Takahiro Ishikawa, Tatsuki Oda, Naoshi Suzuki, and Katsuya Shimizu, Review on distorted face-centered cubic phase in yttrium via genetic algorithm, High Pressure Research (regular article), Published online: 25 Nov 2014 DOI: http://dx.doi.org/10.1080/08957959.2014.983501
  • Takahiro Ishikawa, Akitaka Nakanishi, Katsuya Shimizu, Hiroshi Katayama-Yoshida, Tatsuki Oda, and Naoshi Suzuki, Superconducting H5S2 phase in sulfur-hydrogen system under high-pressure, Scientific Reports (Sci. Rep.) 6, 23160; doi: 10.1038/srep23160 (2016). Published online on 17th March 2016.DOI: http://dx.doi.org/10.1038/srep23160
  • Takahiro Ishikawa, Akitaka Nakanishi, Katsuya Shimizu, and Tatsuki Oda, Phase Stability and Superconductivity of Compressed Argon-Hydrogen Compounds from First-Principles, J. Phys. Soc. Jpn. 86, 124711(2017). Published online November 14, 2017. DOI: https://doi.org/10.7566/JPSJ.86.124711
強磁性形状記憶合金
  • Tomáš Koubský, P. Sedlák, H. Seiner, Jaroslava Fojtikova, Masao Obata, Tatsuki Oda, and Ladislav Kalvoda, Ab Initio study of martensitic transition in Ni2MnGa, ACTA PHYSICA POLONICA A 134(3) (2018) 804-806. DOI: http://dx.doi.org//10.12693/APhysPolA.134.804
外部印加磁場の第一原理的研究
  • Afrioni Roma Rio, Indra Pardede, Achmad Maulana Gani, Mega Christivana, Masao Obata, and Tatsuki Oda, Density functional approach under external magnetic field, J. Phys. Soc. Jpn., accepted for publication on 23th January 2020, DOI: https://journals.jps.jp/journal/jpsj

年代別出版論文

2020年~
  • Indra Pardede, Daiki Yoshikawa, Tomosato Kanagawa, Nurul Ikhsan, Itsuki Murata, Masao Obata, Tatsuki Oda, Anatomy of large perpendicular magnetic anisotropy in free-standing Co/Ni(111) multilayer, J. Magn. Magn. Mater., 500, 166357 (2020),DOI:https://doi.org/10.1016/j.jmmm.2019.166357.
  • Afrioni Roma Rio, Indra Pardede, Achmad Maulana Gani, Mega Christivana, Masao Obata, and Tatsuki Oda, Density functional approach under external magnetic field, J. Phys. Soc. Jpn., accepted for publication on 23th January 2020,DOI: https://journals.jps.jp/journal/jpsj
2010年代

2019年

  • Mega Christivana, Masao Obata, and Tatsuki Oda, Noncollinear magnetic structure with spin- dependent van der Waals density functional approach: beta-phase solid oxygen, J. Phys. Soc. Jpn., 88, 104601 (2019),DOI: https://journals.jps.jp/doi/10.7566/JPSJ.88.104601.
  • Muftah Al-Mahdawi, Mohamed Belmoubarik, Masao Obata, Daiki Yoshikawa, Hideyuki Sato, Tomohiro Nozaki, Tatsuki Oda, and Masashi Sahashi, Large nonvolatile control of magnetic anisotropy in CoPt/ZnO magnetic tunnel junctions, Phys. Rev. B, 100, 054423 (2019), DOI: https://link.aps.org/doi/10.1103/PhysRevB.100.054423

2018年

  • Tomáš Koubský, P. Sedlák, H. Seiner, Jaroslava Fojtikova, Masao Obata, Tatsuki Oda, and Ladislav Kalvoda, Ab Initio study of martensitic transition in Ni2MnGa, ACTA PHYSICA POLONICA A 134(3) (2018) 804-806. DOI: http://dx.doi.org//10.12693/APhysPolA.134.804
  • Nurul Ikhsan, Tomosato Kanagawa, Indra Paradede, Daiki Yoshikawa, and Tatsuki Oda, Perpendicular and in-plane magnetic anisotropies in Cr-buffered Fe(x)/MgO interface from first-principles approach, accepted for publication to The Science Reports of Kanazawa University, Accepted on 23 August 2018.
  • Nurul Ikhsan, Indra Paradede, Tomosato Kanagawa, Daiki Yoshikawa, Masao Obata, and Tatsuki Oda, Fermi level smearing effect in the perpendicular interfac Fe/MgO magnetic anisotropy, accepted for publication to The Science Reports of Kanazawa University, Accepted on 28 August 2018.
  • Tatsuki Oda, Indra Paradede, Tomosato Kanagawa, Nurul Ikhsan, Daiki Yoshikawa, and Masao Obata, Shape Magnetic Anisotropy from Spin Density in Nanoscale Slab Systems, IEEE Transactions on Magnetics, Accepted on 29 August 2018, DOI: https://doi.org/10.1109/TMAG.2018.2868843
  • Masao Obata, Mega Christivana, and Tastuki Oda, Investigation of magnetic dipole-dipole interaction using magnetic density on solid oxygen based on first-principles approach, AIP Advances 8, 101419 (2018) DOI: https://doi.org/10.1063/1.5043062
  • Indra Pardede, Tomosato Kanagawa, Nurul Ikhsan, Itsuki Murata, Daiki Yoshikawa, Masao Obata, and Tatsuki Oda, A comprehensive study of sign change in electric field control perpendicular magnetic anisotropy energy at Fe/MgO interface: first principles calculation, IEEE Transactions on Magnetics (IEEE Trans. Magn.), Volume: 55, Issue: 2, Print ISSN: 0018-9464, Online ISSN: 1941-0069, DOI: https://doi.org/10.1109/TMAG.2018.2860581
  • Tatsuki Oda and Masao Obata, Implementation of magnetic dipole interaction in the planewave-basis approach for slab systems, J. Phys. Soc. Jpn.(Journal of the Physical Society of Japan), 87, 064803 (2018) [8 Pages], Published online on 25 May 2018, DOI: https://doi.org/10.7566/JPSJ.87.064803

2017年

  • Takahiro Ishikawa, Akitaka Nakanishi, Katsuya Shimizu, and Tatsuki Oda, Phase Stability and Superconductivity of Compressed Argon-Hydrogen Compounds from First-Principles, J. Phys. Soc. Jpn. 86, 124711(2017). Published online November 14, 2017. DOI: https://doi.org/10.7566/JPSJ.86.124711

2016年

  • Mohamed Belmoubarik, Muftah Al-Mahdawi, Masao Obata, Daiki Yoshikawa, Hideyuki Sato, Tomohiro Nozaki, Tatsuki Oda, and Masashi Sahashi, Tunneling electroresistance of MgZnO-based tunnel junctions, Applied Physics Letters 109 (2016) 173507, accepted on 12 October 2016, published online on 26 October 2016. DOI: http://dx.doi.org/10.1063/1.4966180
  • Naohiro Kitagawa, Masao Obata, Tatsuki Oda, Density functional study on positively charged six-coordinate FeO2 porphyrin complex for a trigger of O2 dissociation, Chemical Physics Letters 643 (2016) 119–125. DOI: 10.1016/j.cplett.2015.11.026
  • Takahiro Ishikawa, Akitaka Nakanishi, Katsuya Shimizu, Hiroshi Katayama-Yoshida, Tatsuki Oda, and Naoshi Suzuki, Superconducting H5S2 phase in sulfur-hydrogen system under high-pressure, Scientific Reports (Sci. Rep.) 6, 23160; doi: 10.1038/srep23160 (2016). Published online on 17th March 2016.DOI: http://dx.doi.org/10.1038/srep23160
  • Emilia Annese, Takuya Kuzumaki, Beate Müller, Yuta Yamamoto, Hiroto Nakano, Haruki Kato, Atsushi Araki, Minoru Ohtaka, Takashi Aoki, Hirotaka Ishikawa, Takashi Hayashida, Jacek R. Osiecki, Koji Miyamoto, Yasuo Takeichi, Ayumi Harasawa, Koichiro Yaji, Tetsuroh Shirasawa, Koh-ichi Nittoh, Woo Il Yang, Kazushi Miki, Tatsuki Oda, Han Woong Yeom, and Kazuyuki Sakamoto, Nonvortical Rashba spin structure on a surface with C1h symmetry, Phys. Rev. Lett., 117 (2016) 16803, published on 30 June 2016. DOI: http://dx.doi.org/10.1103/PhysRevLett.117.016803

2015年

  • Masao Obata, Makoto Nakamura, Ikutaro Hamada, and Tatsuki Oda, Improving the Description of Nonmagnetic and Magnetic Molecular Crystals via the van der Waals Density Functional, J. Phys. Soc. Jpn., 84 (2015) 024715(1-9). DOI: http://dx.doi.org/10.7566/JPSJ.84.024715
  • Masao Obata, Ikutaro Hamada, and Tatsuki Oda, Molecular Interactions for Modeling of Oxygen System Using van der Waals Density Functional Approach, JPS Conference Proceedings 5, (2015) 011011(1-7). Proceedings of Computational Science Workshop 2014 (CSW2014) Published on February 26, 2015, DOI: http://dx.doi.org/10.7566/JPSCP.5.011011
  • Daiki Yoshikawa, Masao Obata, and Tatsuki Oda, First-principles study on structural and electronic properties in Fe/MgO double interface, JPS Conference Proceedings 5, (2015) 011012 (1-7). Proceedings of Computational Science Workshop 2014 (CSW2014) Published on February 26, 2015, DOI: http://dx.doi.org/10.7566/JPSCP.5.011012
  • Masao Obata, Ikutaro Hamada, and Tatsuki Oda, First principles study on solid oxygen using van der Waals density functional, Physics Procedia, 75 (2015) 771-778. The proceedings of ICM 2015(20th International Conference on Magnetism). DOI: http://dx.doi.org/10.1016/j.phpro.2015.12.100.

2014年

  • Makoto Nakamura, Masao Obata, Tetsuya Morishita, Tatsuki Oda, An ab initio approach to free-energy reconstruction using logarithmic mean force dynamics, J. Chem. Phys., 140 (2014) 184110(1-10). DOI: http://dx.doi.org/10.1063/1.4874654
  • Takahiro Ishikawa, Hitose Nagara, Tatsuki Oda, Naoshi Suzuki, and Katsuya Shimizu, Phase with pressure-induced shuttlewise deformation in dense solid atomic hydrogen, Phys. Rev. B 90, (2014) 104102(1-6). DOI: http://dx.doi.org/10.1103/PhysRevB.90.104102.
  • Kazuyuki Sakamoto, Tatsuki Oda, Akio Kimura, Yasuo Takeichi, Jun Fujii, R. I. G. Uhrberg, Markus Donath, Han Woong Yeom, Symmetry-induced peculiar Rashba effect on thallium adsorbed Si(111) surfaces, Journal of Electron Spectroscopy and Related Phenomena, in press, 2014. DOI: http://dx.doi.org/10.1016/j.elspec.2014.09.008)
  • Daiki Yoshikawa, Masao Obata, Yusaku Taguchi, Shinya Haraguchi, and Tatsuki Oda, Possible origin of non-linear magnetic anisotropy variation in electric field effect in a double interface system, Applied Physics Express, 7 (2014) 113005(1-4). DOI: http://dx.doi.org/10.7567/APEX.7.113005
  • Takahiro Ishikawa, Tatsuki Oda, Naoshi Suzuki, and Katsuya Shimizu, Review on distorted face-centered cubic phase in yttrium via genetic algorithm, High Pressure Research (regular article), Published online: 25 Nov 2014 DOI: http://dx.doi.org/10.1080/08957959.2014.983501

2013年

  • Kazuyuki Sakamoto, Tae-Hwan Kim, Takuya Kuzumaki, Beate Müller, Yuta Yamamoto, Minoru Ohtaka, Jacek Osiecki, Koji Miyamoto, Yasuo Takeichi, Ayumi Harasawa, Sebastian D. Stolwijk, Anke B. Schmidt, Jun Fujii, Roger I. G. Uhrberg, Markus Donath, Han Woong Yeom and Tatsuki Oda, Valley spin polarization by extraordinary Rashba spin on silicon, Nat. Commun., 4, 2073, http://dx.doi.org/10.1038/ncomms3073, (2013) (6 pages).
  • Masao Obata, Makoto Nakamura, Ikutaro Hamada, and Tatsuki Oda, Implementation of van der Waals density functional approach to the spin polarized system: interaction potential between oxygen molecules, J. Phys. Soc. Jpn., 82 (2013) 093701(1-5). DOI: http://dx.doi.org/10.7566/JPSJ.82.093701

2012年

  • Shuhei Kawamoto, Takeshi Miyakawa, Masako Takasu, Ryota Morikawa, Tatsuki Oda, Hiroaki Saito, Shiroh Futaki and Hidemi Nagao, Cell penetrating peptide induces various deformations of lipid bilayer membrane: inverted micelle, double bilayer and trans-membrane, International Journal of Quantum Chemistry, 112 (2012), 178-183. ( January 2012) DOI: http://dx.doi.org/10.1002/qua.23177
  • Shuhei Kawamoto, Masako Takasu, Takeshi Miyakawa, Ryota Morikawa, Tatsuki Oda, Shiroh Futaki, and Hidemi Nagao, Binding of Tat Peptides on DOPC and DOPG Lipid Bilayer Membrane Studied by Molecular Dynamics Simulations, Molecular Simulation, 38(5), (2012), 366-368.(published on 2012-03-20) DOI: http://dx.doi.org/10.1080/08927022.2010.536546
  • Masahito Tsujikawa, Shinya Haraguchi, and Tatsuki Oda, Effect of atomic monolayer insertions on electric-field-induced rotation of magnetic easy axis, J. Appl. Phys., 111 (2012) 083910(1-4). DOI: http://dx.doi.org/10.1063/1.3703682
  • Tetsuro Ueno, Masahiro Sawada, Kazuhito Furumoto, Tetsuro Tagashira, Satoshi Tohoda, Akio Kimura,Shinya Haraguchi,Masahito Tsujikawa, Tatsuki Oda, Hirofumi Namatame, and Masaki Taniguchi, Interface atomic structures and magnetic anisotropy of Fe and Pd/Fe monatomic films on Pd(001), Phys. Rev. B, 85 (2012) 224406(1-11), DOI: http://dx.doi.org/10.1103/PhysRevB.85.224406

2011年

  • Masahito Tsujikawa, Shinya Haraguchi, Tatsuki Oda, Yoshio Miura and Masafumi Shirai, A Comparative Ab Initio Study on Electric-Field Dependence of Magnetic Anisotropy in MgO/Fe/Pt and MgO/Fe/Au Films, J. Appl. Phys., 109 (2011) 07C107(1-3). DOI: http://dx.doi.org/10.1063/1.3540677
  • Shinya Haraguchi, Masahito Tsujikawa, Junpei Gotou, Tatsuki Oda, Electric-field effects on magnetic anisotropy in Pd/Fe/Pd(001) surface, J. Phys. D: Appl. Phys., 44 (2011) 064005(1-8). DOI: http://dx.doi.org/10.1088/0022-3727/44/6/064005
  • Shuhei Kawamoto, Masako Takasu, Takeshi Miyakawa, Ryota Morikawa, Tatsuki Oda, Shiroh Futaki and Hidemi Nagao, Inverted micelle formation of cell-penetrating peptide studied by coarse-grained simulation: Importance of attractive force between cell-penetrating peptides and lipid head group, J. Chem. Phys., 134 (2011), 095103(1-6). DOI: http://dx.doi.org/10.1063/1.3555531
  • Junpei Gotou, Shinya Haraguchi, Masahito Tatsuki Oda, Time benchmarks for the OpenMP and GPU parallelized calculation in the planewave pseudopotential density functional approach, Recent Development in Computational Science (ISSN 2223-0785), 2 (2011) 17-25.
  • Athiya M. Hanna, Toru Yoshizaki, Muhamad A. Martoprawiro, Tatsuki Oda, High-pressure crystal structure prediction, using evolutionary algorithm simulation, Recent Development in Computational Science (ISSN 2223-0785), 2 (2011) 37-45.

2010年

  • A. Araki, T. Nishijima, M. Tsujikawa and T. Oda, Spin-splitting band dispersions of the heavy elements on Si (111)-(1×1) surface, J. Phys.: Conf. Ser.(Conference Series), 200 (2010) 062001(1-4). DOI: http://dx.doi.org/10.1088/1742-6596/200/6/062001
  • Yoshiaki Hashimoto, Masako Takasu, Shuhei Kawamoto, Tatsuki Oda, Hidemi Nagao, Takamasa Sakai and Ung-il Chung, Structure and dynamics of tetra-PEG gel by Brownian dynamics, Transactions of the Materials Research Society of Japan, 35 (2010) 547-553. http://u111u.info/kc25
2000年代

2009年

  • M. Tsujikawa and T. Oda, Electronic structure and magnetic anisotropy of a constrained Fe chain in electric field, J. Phys.: Condens. Matter, 21 (2009) 064213 (1-6). DOI: http://dx.doi.org/10.1088/0953-8984/21/6/064213
  • K. Sakamoto, T. Oda, A. Kimura, K. Miyamoto, M. Tsujikawa, A. Imai, N. Ueno, H. Namatame, M. Taniguchi, P. E. J. Eriksson, and R. I. G. Uhrberg, Abrupt rotation of the Rashba spin to the direction perpendicular to the surface, Phys. Rev. Lett., 102 (2009) 096805(1-4). DOI: http://dx.doi.org/10.1103/PhysRevLett.102.096805
  • N. Fujima and T. Oda, Bonding properties and structures of titanium clusters on (10, 0) single wall carbon nano capsule, Eur. Phys. J. D., 52 (2009) 87-90. DOI: http://dx.doi.org/10.1140/epjd/e2009-00066-0
  • M. Tsujikawa and T. Oda, Finite electric field effects in the large perpendicular magnetic anisotropy surface Pt/Fe/Pt(001): a first principles study, Phys. Rev. Lett., 102 (2009) 247203(1-4). DOI: http://dx.doi.org/10.1103/PhysRevLett.102.247203
  • I. Hamada, T. Oda, N. Suzuki, and H. Katayama-Yoshida, Variational Density-Functional Perturbation Theory with Ultrasoft Pseudopotentials, J. Compt. Theor. Nano. ( Journal of Computational and Theoretical Nanoscience), 6 (2009) 2550-2558. DOI: http://dx.doi.org/10.1166/jctn.2009.1314
  • M. Tsujikawa, and T. Oda, Electronic Structure and Magnetic Anisotropy in Iron Chains from a First-Principles Study, J. Compt. Theor. Nano. ( Journal of Computational and Theoretical Nanoscience), 6 (2009) 2597-2602. DOI: http://dx.doi.org/10.1166/jctn.2009.1320
  • T. Oda, Y. Yokoo, H. Sakashita, and M. Tsujikawa, Magnetic Anisotropy in Small Clusters FePt, Fe2Pt, and FePt2 : from a First-Principles Study, J. Compt. Theor. Nano.( Journal of Computational and Theoretical Nanoscience), 6 (2009) 2603-2607.DOI: http://dx.doi.org/10.1166/jctn.2009.1321

2008年

2007年

  • A. Hosokawa, M. Tsujikawa, H. Shiroishi and T. Oda, Development of Fully Relativistic Pseudopotentials and Application to a Thin Magnetic Film on the Metal, J. Magn. Magn. Mater., 310 (2007) 1637-1639. DOI: http://dx.doi.org/10.1016/j.jmmm.2006.10.491
  • M. Tsujikawa, A. Hosokawa and T. Oda, Magnetic Anisotropies of Iron on the Low Index Platinum Surface, J. Magn. Magn. Mater., 310 (2007) 2189-2191. DOI: http://dx.doi.org/10.1016/j.jmmm.2006.10.754
  • H. Shiroishi, T. Oda and N. Fujima, Electronic Structure and Magnetism of Fe-Wire in Carbon Nanotubes, J. Magn. Magn. Mater., 310 (2007) 1640-1641. DOI: http://dx.doi.org/10.1016/j.jmmm.2006.10.860
  • H. Shiroishi, T. Oda, H. Sakashita and N. Fujima , Structure and Magnetism in Carbon Nanotubes Including Magnetic Wire, Eur. Phys. J. D, 43 (2007) 129-132.
  • N. Fujima, R. Tamura and T. Oda, Structure and Electronic Properties of Heterojunction of Single Wall Carbon Nanotube and TiC Cluster, Eur. Phys. J. D, 43 (2007) 147-150.
  • M. Tsujikawa, A. Hosokawa and T. Oda, Magnetic Anisotropies of Iron on the Pt (111) Surface, J. Phys.: Condens. Matter, 19 (2007) 365208 (1-8); Erratum 19 (2007) 479002 (1-1). DOI: http://dx.doi.org/10.1088/0953-8984/19/36/365208
  • T. Oda K. Sugimori, H. Nagao, I. Hamada, S. Kagayama, M. Geshi, H. Nagara, K. Kusakabe and N. Suzuki, Oxygen at High Pressures : Theoretical Approach to Monoatomic Phases, J. Phys.: Condens. Matter, 19 (2007) 365211 (1-7). DOI: http://dx.doi.org/10.1088/0953-8984/19/36/365211
  • K. Wako, I. Okada, M. Tachibana, K. Kojima and T. Oda, Formation of a Five-Seven Pair Couple Defect in Double-Walled Carbon Nanotubes under Bending Deformation, J. Appl. Phys., 102 (2007) 113522 (1-7). DOI: http://dx.doi.org/10.1063/1.2821247
  • M. Saito, K. Yamashita and T. Oda, Magic Numbers of Graphene Multivacancies, Jpn. J. Appl. Phys, 46 (2007) L1185 – L1187. DOI: http://dx.doi.org/10.1143/JJAP.46.L1185

2006年

2005年

2004年

  1. T. Oda and A. Pasquarello, Noncollinear Magnetism in Liquid Oxygen: A First-Principles Molecular Dynamics Study, Phys. Rev. B, 70 (2004) 134402(1-19). DOI: http://dx.doi.org/10.1103/PhysRevB.70.134402
  2. H. Shiroishi, T. Oda, I. Hamada and N. Fujima , Structure and Magnetism on Anion Iron Oxide Clusters FenOm- (n=1,2) , Mol. Simul., 30 (2004) 911-915.

2003年

2002年

  • T. Oda, Metallic Car-Parrinello Dynamics, J. Phys. Soc. Jpn., 71, (2002) 519-524. DOI: http://dx.doi.org/10.1143/JPSJ.71.519
  • N. Fujima and T. Oda, Non-collinear Magnetic Moment of Linear-Chain Fe Clusters, Trans. Mat. Res. Soc. Jpn., 27 (2002) 201-204.
  • M. Geshi, T. Oda and Y.Hiwatari, Electronic Structure and Space Group of the Orthorhombic Selenium under High Pressure, J. Phys.: Condens. Matter, 14 (2002) 10885-10890. DOI: http://dx.doi.org/10.1088/0953-8984/14/44/395
  • T. Oda and A. Pasquarello, Ab Initio Molecular Dynamics Investigation of the Structure and the Noncollinear Magnetism in Liquid Oxygen : Occurrence of O4 Molecular Units, Phys. Rev. Lett., 89 (2002) 197204(1-4). DOI: http://dx.doi.org/10.1103/PhysRevLett.89.197204

2001年

  • M. Geshi, T. Oda and Y. Hiwatari, Electronic Structure and Structural Stability of the High-Pressured Orthorhombic Phase of Selenium, J. Phys.: Condens. Matter ,13 (2001) 9401-9410. DOI: http://dx.doi.org/10.1088/0953-8984/13/42/301
  • T. Oda, Magnetic Excitation of Ferromagnetic Dimer Molecules, Eur. Phys. J. D., 16 (2001) 181-184.

2000年

  • T. Oda and Y. Hiwatari, Order-N Tight-Binding Molecular Dynamics Simulation with a Fermi Operator Expansion Approach: Application to a Liquid Carbons, J. Phys.: Condens. Matter , 12 (2000) 1627-1639. DOI: http://dx.doi.org/10.1088/0953-8984/12/8/305
  • T. Oda and Y. Hiwatari, Tight-Binding Molecular-Dynamics with the Fermi Operator Expansion : Application to Liquid Carbons, Prog. Theor. Phys., Suppl., 138 (2000) 124-125..
  • M. Geshi, T. Oda and Y. Hiwatari, Electronic Structures and Phase Transitions of Selenium under High Pressure with FLAPW method, Prog. Theor. Phys., Suppl., 138 (2000) 249-250.
  • I. Hamada, T. Oda, and N. Suzuki, Theoretical Study on Pressure-Induced Structural Phase Transitions in Phosphorus, Science and Technology of High Pressure (Proceedings of AIRAPT-17), edited by M.H. Manghnani, W. J. Nellis and M. F. Nicol, (Universities Press, Hyderabad, India), 467-470, 2000.
1990年代

1999年

1998年

  • K. Uehara, T. Oda, Y. Hiwatari and M. Ishitobi, First-Principles Molecular Dynamics Calculation of Selenium Clusters, Proceedings of the International Symposium, The Physics of Complex Liquids, ed. F. Yonezawa, K. Tsuji, K. Kaji, M. Doi, T. Fujiwara,(Singapore: World Scientific),(1998) p.144-152.
  • T. Oda, A. Pasquarello and R. Car, Fully Unconstrained Approach to Noncollinear Magnetism: Application to Small Fe Clusters, Phys. Rev. Lett. 80 (1998) 3622-3625. DOI: http://dx.doi.org/10.1103/PhysRevLett.80.3622
  • M. Geshi, T. Oda and Y. Hiwatari, High Pressure Phases and the Structural Phase Transition of Selenium, J. Phys. Soc. Jpn., 67 (1998) 3141-3146. DOI: http://dx.doi.org/10.1143/JPSJ.67.3141

1997年

1996年

  • T. Oda, M. Shirai, N.Suzuki and K. Motizuki, First-Principles Study on Lattice Dynamics and Electron-Phonon Interaction in an Oxide Spinel LiTi2O4, Physica B, 219&220 (1996) 451-453.DOI: http://dx.doi.org/10.1016/0921-4526(95)00775-X
  • N.Suzuki, H.Sakamoto, T.Oda and M.Shirai, First-Principles Calculation of Lattice Dynamics and Electron-Phonon Interaction in Hight Pressure Phase of Solid Iodine”, Physica B, 219&220 (1996) 454-456. DOI: http://dx.doi.org/10.1016/0921-4526(96)00776-4
  • H.Sakamoto, T.Oda, M.Shirai and N.Suzuki, Application of Frozen–Phonon Method to Lattice Dynamics in Fcc Solid Iodine, J. Phys. Soc. Jpn., 65 (1996) 489-495. DOI: http://dx.doi.org/10.1143/JPSJ.65.489
  • T.Oda, M.Shirai, N.Suzuki and K.Motizuki, Full-Potential Calculation of Electronic Structure of Sulphide Spinels , Cryst. Res. Technol., 31 (1996) 877-880.

1995年

1994年

  • T.Oda, M. Shirai, N. Suzuki and K. Motizuki, Role of Electron–Phonon Interaction in Lattice Dynamics and Superconductivity of an Oxide Spinel LiTi2O4, J. Supercond., 7 (1994) 555-558.
  • T. Oda, M. Shirai, N. Suzuki and K. Motizuki, Electron-Phonon Interaction, Lattice Dynamics and Superconductivity of an Oxide Spinel LiTi2O4, J. Phys.: Condens. Matter, 6 (1994) 6997-7012. DOI: http://dx.doi.org/10.1088/0953-8984/6/35/009