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東北大学金属材料研究所川添研究室-Institute for Materials Research, Tohoku University Kawazoe Laboratory

 

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Kawazoe Laboratory Publications
(2005)

  1. TiO2 (rutile) Doped with Double Impurities for Fabricating Spintronic Devices-A Combinatorial Computational Approach

    Meas. Sci. Technol, 16 (2005) pp.242-247

    P. Murugan, R.V. Belosludov, H. Mizuseki, T. Nishimatsu, T. Fukumura, M. Kawasaki and Y. Kawazoe

  2. First-principles Study of Ferromagnetic Coupling in Zn1-xCrxTe Thin Film

    J. Appl. Phys., 97 (2005) pp.0439041-0439046

    Q. Wang, Q. Sun, P. Jena and Y. Kawazoe

  3. Nonlinear Charging and Transport Times in Doped Nanotubes Junctions

    Phys. Soc. Jpn., 74[2] (2005) pp.515-518

    Keivan Esfarjani, Amir A. Farajian, Yoshiyuki Kawazoe and Siu Tat Chui

  4. Atomic Structures and Magnetic Behavior of Small Ruthenium Clusters

    Mater. Trans., 46[2] (2005) pp.159-162

    Young-Cho Bae, Hiroki Osanai, Vijay Kumar and Yoshiyuki Kawazoe

  5. Prediction of Site Preference and Phase Stability of Transition Metal Based Frank-Kasper Phases

    The Science of Complex Alloy Phases (2005) pp.409-436 (From: 2005 TMS Annual Meeting & Exhibition, San Francisco USA (2005.2.13-17)

    Marcel H.F. Sluiter, Alain Pasturel, Yoshiyuki Kawazoe

  6. Electron Transport Through Molecular Wire: Effect of Isomery

    Physica E, 25 (2005) pp.643-646

    W.W. Cheng, H. Chen, R. Note, H. Mizuseki and Y. Kawazoe

  7. Effect of Time-reversal Symmetric Gauge Fields on the Groundstate Properties of Carbon Nanotubes and Tori Persistent Currents in Twisted Tori and Local Energy Gap in Deformed Tubes

    Phys. Stat. Sol. B., 242[2] (2005) pp.203-210

    Ken-ichi Sasaki and Yoshiyuki Kawazoe

  8. Local Energy Gap in Deformed Carbon Nanotubes

    Prog. Theor. Phys., 113[3] (2005) pp.463-480

    Ken-ichi Sasaki, Yoshiyuki Kawazoe and Riichiro Saito

  9. Design of a Very Thin Direct-band-gap Semiconductor Nanotube of Germanium with Metal Encapsulation

    Phys. Rev. B., 71[7] (2005) pp.0753121-0753125

    Abhishek Kumar Singh, Vijay Kumar and Yoshiyuki Kawazoe

  10. Growth Behavior of Metal-doped Silicon Clusters SinM (M=Ti, Zr, Hf; n=8-16)

    Phys. Rev. B., 71[7] (2005) pp.07542301-07542312

    Hiroaki Kawamura, Vijay Kumar and Yoshiyuki Kawazoe

  11. Atomic and Electronic Structures of Neutral and Cation Snn (n=2-20) Clusters: A Comparative Theoretical Study with Different Exchange-Correlation Functionals

    Phys. Rev. B., 71[3] (2005) pp.03540101-03540110

    Chiranjib Majumder, Vijay Kumar, Hiroshi Mizuseki and Yoshiyuki Kawazoe

  12. Hysteretic Current-Voltage Characteristics and Resistance Switching at an Epitaxial Oxide Schottky Junction SrRuO3/SrTi0.99Nb0.01O3

    Appl. Phys. Lett., 86[1] (2005) pp.0121071-0121073

    T. Fujii, M. Kawasaki, A. Sawa, H. Akoh, Y. Kawazoe, and Y. Tokura

  13. Electronic and Transport Properties of Doped Organic Molecules for Molecular Wire Applications

    Jpn. J. Appl. Phys., 44[4B] (2005) pp.2823-2825

    Rodion V. Belosludov, Amir A. Farajian, Hidetoshi Baba, Hiroshi Mizuseki and Yoshiyuki Kawazoe

  14. Theoretical Study on Planar Anionic Polysilicon Chains and Cyclic Si6 Anions with D6h Symmetry

    Organometallics, 24[10] (2005) pp.2433-2440

    Masae Takahashi and Yoshiyuki Kawazoe

  15. Stabilizing the Silicon Fullerene Si20 by Thorium Encapsulation

    Phys. Rev. B, 71[11] (2005) pp.1154291-1154296

    Abhishek Kumar Singh, Vijay Kumar and Yoshiyuki Kawazoe

  16. Thermodynamic Properties of Transition Metals Using Face-Centered-Cubic Lattice Model with Renormalized Potentials

    Mater. Trans, 46[6] (2005) pp.l127-1130

    Ryoji Sahara, Hiroshi Mizuseki, Kaoru Ohno and Yoshiyuki Kawazoe

  17. Highly Controlled Acetylene Accommodation in a Metal-Organic Microporous Material

    Nature, 436[7048] (2005) pp.238-241

    Ryotaro Matsuda, Ryo Kitaura, Susumu Kitagawa, Yoshiki Kubota, Rodion V. Belosludov, Tatsuo C. Kobayashi, Hirotoshi Sakamoto, Takashi Chiba, Masaki Takata, Yoshiyuki Kawazoe and Yoshimi Mita

  18. Atomic Structures and Magnetism in Small MoS2 and WS2 Clusters

    Phys. Rev. A, 71[6] (2005) pp.0632031-0632036

    P. Murugan, Vijay Kumar, Yoshiyuki Kawazoe and Norio Ota

  19. Silica-Coating of Fluorescent Polystyrene Microspheres by a Modified Stoeber Method and their Stability against Photo-Bleaching

    e-Polymers, 52 (2005) pp.1-8

    Yoshio Kobayashi, Kiyoto Misawa, Masaki Kobayashi, Motohiro Takeda, Mikio Konno, Masanobu Satake, Yoshiyuki Kawazoe, Noriaki Ohuchi, Atsuo Kasuya

  20. Origin of Spontaneous Electric Dipoles in Homonuclear Niobium Clusters

    Phys. Rev. Lett., 95[8] (2005) p.089901

    Kristopher E. Andersen, Vijay Kumar, Yoshiyuki Kawazoe and Warren E. Pickett

  21. Atomic-Scale Structure of SixGe1-x Solid Solutions

    Journal of Metastable and Nanocrystalline Materials, 24-25 (2005) pp.523-526

    I. Yonenaga, M. Sakurai, M.H.F. Sluiter and Y. Kawazoe

  22. First Principles Based Design and Experimental Evidence for a ZnO-Based Ferromagnet at Room Temperature

    Phys. Rev. Lett., 94[18] (2005) pp.1872041-1872044

    Marcel H. F. Sluiter, Y. Kawazoe, Parmanand Sharma, A. Inoue, A. R. Raju, C. Rout and U. V. Waghmare

  23. Thorium Encapsulated Caged Clusters of Germanium: Th@Gen, n=16, 18, and 20

    J. Phys. Chem. B, 109[32] (2005) pp. 15187-15189

    Abhishek Kumar Singh, Vijay Kumar, and Yoshiyuki Kawazoe

  24. Dynamic Ad-Dimer Twisting Assisted Nanowire Self-Assembly on Si(001)

    Phys. Rev. Lett., 94[22] (2005) pp.2261031-2261034

    Jian-Tao Wang, E. G. Wang, D. S. Wang, H. Mizuseki, Y. Kawazoe, M. Naitoh and S. Nishigaki

  25. Controlling Edge States of Zigzag Carbon Nanotubes by the Aharonov-Bohm Flux

    Phys. Rev. B, 71[19] (2005) pp.1954011-1954015

    K. Sasaki, S. Murakami, R. Saito and Y. Kawazoe

  26. Ab initio Study of Ferromagnetism in Ga1-xCrxN Thin Films

    Phys. Rev. B, 72[4] (2005) pp.0454351-0454356

    Q. Wang, Q. Sun, P. Jena, J. Z. Yu, R. Note and Y. Kawazoe

  27. Interactions of Uranium Atom with Tetraketone Complexes

    Chem. Phys. Lett., 415 (2005) pp.243-245

    Q. Sun, Q. Wang. Y. Shiokawa, Y. Kawazoe

  28. Encapsulation of Halide Anions in Perhydrogenated Silicon Fullerene: X-@Si20H20 (X = F, Cl, Br, I)

    Chem. Phys. Lett., 406[4-6] (2005) pp.341-344

    Fabio Pichierri, Vijay Kumar and Yoshiyuki Kawazoe

  29. Band-Structure Design of Fluoride Complex Materials for Deep-Ultraviolet Light-Emitting Diodes

    Jpn. J. Appl. Phys., 44[10] (2005) pp.7285-7290

    Shingo Ono, Riadh El Ouenzerfi, Alex Quema, Hidetoshi Murakami, Nobuhiko Sarukura, Takeshi Nishimatsu, Noriaki Terakubo, Hiroshi Mizuseki, Yoshiyuki Kawazoe, Akira Yoshikawa and Tsuguo Fukuda

  30. An Ab Initio Study of Single-Walled Nanotubes Bombarded with 50-150 eV Cs+ Ions

    Chem. Phys. Lett., 415 (2005) pp.34-39

    Mohammad Khazaei, Amir A. Farajian, Hiroshi Mizuseki and Yoshiyuki Kawazoe

  31. GaN Nanodot Fabrication by Implant Source Growth

    Microelectronics Journal 36 (2005) pp.456-459

    R. Buckmaster, J. H. Yoo, K. Shin, Y. Yao, T. Sekiguchi, M. Yokoyama, T. Hanada, T. Goto, M. Cho, Y. Kawazoe, T. Yao

  32. Invariance of Truncated Cluster Expansions for First-Principles Alloy Thermodynamics

    Phys. Rev. B, 71[21] (2005) pp.2122011-2122012

    Marcel H. F. Sluiter and Y. Kawazoe

  33. Stoichiometric and Ultra-Stable Nanoparticles of II-VI Compound Semiconductors

    Eur. Phys. J. D, 34 (2005) pp.39-41

    A. Kasuya, Y. Noda, I. Dmitruk, V. Romanyuk, Y. Barnakov, K. Tohji, V. Kumar, R. Belosludov, Y. Kawazoe and N. Ohuchi

  34. Metal Encapsulated Nanotubes of Germanium with Metal Dependent Electronic Properties

    Eur. Phys. J. D, 34 (2005) pp.295-298

    A. Kumar Singh, V. Kumar and Y. Kawazoe

  35. First-Principles Study of the Onset of Noncollinearity in Mnn Clusters: Magnetic Arrengements in Mn5 and Mn6

    Phys. Rev. B, 72[1] (2005) pp.0144351-0144354

    T. Morisato, S. N. Khanna and Y. Kawazoe

  36. Ab Initio Study of Magnetism in Palladium Clusters Supported on (110) Surface of TiO2 Rutile

    Int. J. Mod. Phys. B, 19 (2005) pp.2544-2549

    P. Murugan, Vijay Kumar and Yoshiyuki Kawazoe

  37. Growth Behaviors and Electronic Structures of Na and Cu Nanoclusters: The Role of sp-d Hybridization

    Int. J. Mod. Phys. B, 19 (2005) pp.2421-2426

    Masahiro Itoh, Vijay Kumar and Yoshiyuki Kawazoe

  38. Evolution of the Electronic Structure of Be Clusters

    J. Chem. Phys., 123[7] (2005) pp.07432901-07432910

    V. Cerowski, B. K. Rao, S. N. Khanna, P. Jena, Soh Ishii, Kaoru Ohno and Yoshiyuki Kawazoe

  39. Atomistic Structure and Strain relaxation in Czochralski-grown SixGe1-x bulk alloys

    J. Mater. Sci. Mater. Electron., 16 (2005) pp.429-432

    I. Yonenaga, M. Sakurai, M. H. F. Sluiter, Y. Kawazoe and S. Muto

  40. Cubic Magic Clusters of Rhodium Stabilized with Eight-Center Bonding: Magnetism and Growth

    Phys. Rev. B, 72[12] (2005) pp.1254271-1254276

    Young-Cho Bae, Vijay Kumar, Hiroki Osanai and Yoshiyuki Kawazoe

  41. ab initio Study of Strain-Induced Ferroelectricity in SrTiO3

    Jpn. J. Appl. Phys., 44[9B] (2005) pp.7134-7140

    Takatoshi Hashimoto, Takeshi Nishimatsu, Hiroshi Mizuseki, Yoshiyuki Kawazoe, Atsushi Sasaki and Yoshiaki Ikeda

  42. Magnetic Coupling between Cr Atoms Doped at Bulk and Surface Sites of ZnO

    Appl. Phys. Lett., 87[16] (2005) pp.1625091-1625093

    Q. Wang, Q. Sun, P. Jena and Y. Kawazoe

  43. Field Emission Patterns from First-Principles Electronic Structures: Application to Pristine and Cesium-Doped Carbon Nanotubes

    Phys. Rev. Lett., 95[17] (2005) pp. 1776021-1776024

    Mohammad Khazaei, Amir A. Farajian and Yoshiyuki Kawazoe

  44. Clustering of Ti on a C60 Surface and Its Effect on Hydrogen Storage

    J. Am. Chem. Soc., 127 (2005) pp.14582-14583

    Qiang Sun, Qian Wang, Puru Jena and Yoshiyuki Kawazoe

  45. Structure of the Thinnest Most Stable Semiconducting and Insulating Nanotubes of SiOx (x = 1,2)

    Phys. Rev. B, 72[15] (2005) pp.1554221-1554225

    Abhishek Kumar Singh, Vijay Kumar and Yoshiyuki Kawazoe

  46. Ab Initio Study of Molecule Transport Characteristics Based on Nonequilibrium Green's Function Theory

    Phys. Rev. B, 72[15] (2005) pp.15540801-15540810

    F. Jiang, Y. X. Zhou, H. Chen, R. Note, H. Mizuseki and Y. Kawazoe

  47. Dynamics and Nano-Clustering of Alkali Metals (Na, K) on the Si(1 1 1)-(7×7) Surface

    Ultramicroscopy 105 (2005) pp.32-41

    Kehui Wu, Y. Fujikawa, T. Briere, V. Kumar, Y. Kawazoe and T. Sakurai

  48. Pristine Semiconducting [110] Silicon Nanowires

    Nano Lett., 5[11] (2005) pp.2302-2305

    Abhishek Kumar Singh, Vijay Kumar, Ryunosuke Note and Yoshiyuki Kawazoe

  49. Reconstruction of Atomic Images from Multiple-Energy X-ray Holograms of FePt Films by the Scattering Pattern Matrix Method

    Appl. Phys. Lett., 87[23] (2005) pp.2341041-2341043

    Yukio Takahashi, Eiichiro Matsubara, Yoshiyuki Kawazoe, Koki Takanashi and Toshiyuki Shima

  50. Theoretical Study on Junctions in Porphyrin Oligomers for Nanoscale Devices

    Mater. Sci. Eng. C, 25 (2005) pp.718-721

    Hiroshi Mizuseki, Rodion V. Belosludov, Amir A. Farajian, Nobuaki Igarashi and Yoshiyuki Kawazoe

  51. Cofolga: a Genetic Algorithm for Finding the Common Folding of Two RNAs

    Computational Biology and Chemistry, 29 (2005) pp.111-119

    Akito Taneda

  52. Interactions of Uranium Atom with Tetraketone Complexes

    Chem. Phys. Lett., 415 (2005) pp.243-245

    Q. Sun, Q. Wang, Y. Shiokawa and Y. Kawazoe

  53. Ferromagnetic GaN-Cr Nanowires

    Nano Lett., 5[8] (2005) pp.1587-1590

    Q. Wang, Q. Sun, P. Jena and Y. Kawazoe

Contact Address

Institute For Materials Research Tohoku University
Katahira 2-1-1
Aoba-ku, Sendai
980-8577 Japan
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(81)22-215-2054
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東北大学
東北大学 金属材料研究所
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