Yasushi Shibuta, Ph.D.
   (ResearcherID:A-6301-2010)

    Associate Professor
    Department of Materials Engineering
    The University of Tokyo

   Index    Profile    Research    Publication & Presentation    Etc    Lab
   Journal    Conference(int'l, abroad)    Conference(in Japan)    Workshop    Seminar    Book

   2015    2013    2013    2012    2011    2010    2009    2008    2007    2006    2001-2005

last update, 18 Mar, 2015   
2015
63. Y. Shibuta*
"Discussion on carbon precursor dissociation at initial stage of
carbon nanotube growth"

CCTN15, Nagoya, Japan (scheduled).
(invited)

62. Y. Shibuta*
"Phase transition in nanoscale: molecular dynamics simulation of
solidification of metal nanodroplets"

EMN Meetings on Droplets, Phuket, Thailand (scheduled).
(invited)

61. Y. Shibuta*, K. Shimamura, T. Oguri, R. Arifin, F. Shimojo, S. Yamaguchi
"Ethanol decomposition on transition metal nanoparticles during carbon nanotube
growth: ab initio molecular dynamics study"

APS March Meeting 2015 , San Antonio, USA (2015).


2014
60. Y. Shibuta*, K. Oguchi, M. Ohno
"Spontaneous evolution of anisotropy in solid nucleus during solidification of iron:
million-atom molecular dynamics simulation performed on graphic processing unit"

2014 MRS Fall Meeting, Boston, USA, (2014).

59. Y. Maekawa*, Y. Shibuta,T. Sakata
"Elucidation of semiconductor/bio-interface structure
by molecular dynamics simulation "

SSDM 2014, Tsukuba, Japan, (2014).

58. T. Oguri, K. Shimamura, Y. Shibuta*, F. Shimojo, S. Yamaguchi
"Ab initio molecular dynamics study of bond dissociation mechanism of ethanol
during carbon nanotube growth via CVD process"

NT14 , Los Angeles, USA (2014).

57. Y. Shibuta*, K. Shimamura, T. Oguri, R. Arifin, W. Hashizume, F. Shimojo, S. Yamaguchi
"Role of catalytic metals on formation process of carbon nanotube and graphene:
ab initio molecular dynamics study"

APS March Meeting 2014 , Denver, USA (2014).


2013
56. Y. Shibuta*, R. Arifin, K. Shimamura, T. Oguri, F. Shimojo, S. Yamaguchi
"Understanding initial dissociation of carbon source molecules on metal surface
during CVD growth of graphene: ab initio molecular dynamics simulation"

2013 MRS Fall Meeting, Boston, USA, (2013).

55. T. Oguri*, K. Shimamura, Y. Shibuta, F. Shimojo, S. Yamaguchi
"Unraveling dissociation of ethanol molecules in initial stage of carbon nanotubes growth
via an ACCVD technique :ab initio molecular dynamics simulation "

2013 MRS Fall Meeting, Boston, USA, (2013).

54. T. Oguri*, K. Shimamura, Y. Shibuta, F. Shimojo, S. Yamaguchi
"Ab initio molecular dynamics study of dissociation of ethanol molecules
on the nickel cluster in initial stage of carbon nanotubes growth"

JCREN2013, Hiroshima, Japan, (2013).

53. Y. Shibuta*, K. Shimamura, T. Oguri, R. Arifin, W. Hashizume, F. Shimojo, S. Yamaguchi
"Understanding initial dissociation process of carbon source molecules during nanotubes
and graphene synthesis: Ab initio molecular dynamics simulations"

CCTN13, Tallinn, Estonia (2013).

52. T. Oguri*, K. Shimamura, Y. Shibuta, F. Shimojo, S. Yamaguchi
"Ab initio molecular dynamics study on the role of nickel cluster as catalytic metal
in carbon nanotubes synthesis"

CCTN13, Tallinn, Estonia (2013).

51. T. Oguri*, K. Shimamura, Y. Shibuta, F. Shimojo, S. Yamaguchi
"Ab initio molecular dynamics study of dissociation of ethanol on nickel cluster
in metal-catalyzed growth of carbon nanotubes"

NT13, Espoo, Finland (2013).
(selected as Poster Award)

50. R. Arifin*, Y. Shibuta, K. Shimamura, F. Shimojo, S. Yamaguchi
"Graphene growth on Ni (111) surface: ab initio molecular dynamics simulation"
NT13, Espoo, Finland (2013).

49. W. Hashizume*, K. Shimamura, R. Arifin, T. Oguri, Y. Shibuta, F. Shimojo, S. Yamaguchi
"Ab initio molecular dynamics study of the effect of water on carbon nanotube growth"
NT13, Espoo, Finland (2013).

48. Y. Shibuta*, R. Arifin, K. Shimamura, T. Oguri, F. Shimojo, S. Yamaguchi
"Ab initio molecular dynamics study of dissociation of methane on nickel surface
in graphene synthesis via a CVD technique"

NT13, Espoo, Finland (2013).


2012
47. Y. Shibuta*, K. Oguchi, T. Suzuki
"Large-scale molecular dynamics simulation of evolution of grain boundary groove
performed on graphic processing unit"

2012 MRS Fall Meeting & Exhibit, Boston, USA, (2012).

46. Y. Shibuta*
"Understanding phase transformation in metal nanoparticles from atomic viewpoint"
ICEAN-2012, Brisbane, Australia (2012).
(invited)

45. T. Satoh*, Y. Shibuta, M. Kurata, H. Ohta
"Experimental evaluation of the morphological diagram
in uranium electrodeposition in LiCl-KCl eutectic melts"

NuMat 2012, Osaka, Japan (2012).

44. K. Shimamura*, Y. Shibuta, S. Ohmura, F. Shimojo, S. Yamaguchi
"Ab initio study of dissociation reaction of ethylene molecules on nickel cluster "
CCP2012, Kobe, Japan (2012).

43. L.-W. Chen*, Y. Shibuta, M. Kambara, T. Yoshida
"Nanocluster dynamic simulation during high rate epitaxial deposition
under mesoplasma condition"

11th APCPST + 25th SPSM, Kyoto, Japan (2012).

42. Y. Shibuta*
"Numerical approach to the role of metal atoms during carbon nanotube growth"
IUMRS-ICYRAM 2012, Singapore (2012).
(invited)


2011
41. L.-W. Chen*, Y. Shibuta, M. Kambara, T. Yoshida
"Molecular dynamics study of nanoclusters' role in mesoplasma epitaxy"
IUMRS-ICA 2011, Taipei (2011).
(received the Outstanding Poster Award)

40. Y. Shibuta*
"Numerical modelling of metal-catalyzed growth process of carbon nanotube
and related properties of catalytic metal nanoparticles"

CCTN11, Cambridge, UK (2011).
(invited)

39. Y. Shibuta*, J.A. Elliott
"Interaction between two graphene sheets with a turbostratic orientational relationship"
NT11, Cambridge, UK (2011).

38. T. Suzuki*, Y. Shibuta, S. Ou,
"Numerical simulation of solidification macrostructures using a moving particle method"
STEEL SIM 2011 (4th International Conference on Modelling and Simulation of
Metallurgical Processes in Steelmaking)
, Dusseldolf, Germany, (2011).

37. L.-W. Chen*, Y. Shibuta, M. Kambara, T. Yoshida
"Molecular dynamics simulation of Si nano-clusters in mesoplasma high rate
and low temperature epitaxy"

2011 MRS Spring Meeting, San Francisco, USA, (2011).


2010
36. Y. Shibuta*, Y. Watanabe, T. Suzuki
"A molecular dynamics study of growth and melting of semi-spherical bcc-iron nanoparticles
on a substrate contacting undercooled liquid iron"

2010 MRS Fall Meeting, Boston, USA, (2010).

35. Y. Shibuta*, S. Unoura, T. Sato, H. Shibata, M. Kurata, T. Suzuki
"A phase-field simulation of uranium dendrite growth on cathode in electrorefining process"
NuMat 2010, Karlsruhe, Germany, (2010).

34. Y. Shibuta*
"A numerical approach to the metal-catalyzed growth process of carbon nanotubes"
Diamond 2010, Budapest, Hungary, (2010).

33. E.C. Neyts*, Y. Shibuta, A.C.T. van Duin, A. Bogaerts
"Catalyzed growth of carbon nanotubes by hybrid molecular dynamics /
force biased Monte Carlo simulations"

NT10, Montreal, Canada, (2010).

32. E.C. Neyts*, Y. Shibuta, A. Bogaerts
"Unravelling the nucleation of SWNTs: Bond switching regimes
in nickel and nickel-carbon nanoclusters"

NT10, Montreal, Canada, (2010).

31. Y. Shibuta*, T. Suzuki
"Molecular dynamics study of phase transition in substrate-supported nanoparticles of bcc metals"
APS March Meeting 2010, Portland, OR, USA (2010).


2009
30. Y. Watanabe, Y. Shibuta, T. Suzuki
"A molecular dynamics study of the growth and melting of metal nanoparticles in melt"
2009 MRS Fall Meeting, Boston, USA (2009).

29. Y. Okajima, Y. Shibuta, T. Suzuki
"Phase-field simulation of dendrite growth in electrodeposition"
216th ECS Meeting, Vienna, Austria (2009).

28. Y. Shibuta, J.A. Elliott
"Numerical modelling of the metal-catalyzed growth process of carbon nanotubes"
NT09, Beijing, China (2009).

27. J.A. Elliott, Y. Shibuta
"A computational study of the graphitization ability of transition metal catalysts
for carbon nanotube synthesis"

NT09, Beijing, China (2009).

26. S. Tateyama, Y. Shibuta, T. Suzuki
"Kinetics of the fcc-bcc phase transformation iron by molecular dynamics"
Asia Steel 2009, Busan, Korea (2009).

25. Y. Watanabe, Y. Shibuta, T. Suzuki
"A molecular dynamics study of the kinetics of the solid-liquid interface of iron"
Asia Steel 2009, Busan, Korea (2009).

24. Y. Shibuta, T. Suzuki
"Molecular dynamics study of the phase transition in the bcc metal nanoparticles"
APS March Meeting 2009, Pittsburgh, USA (2009).


2008
23. Y. Shibuta, J.A. Elliott
"A molecular dynamics study of the graphitization ability of transition metals for catalysis
of carbon nanotube growth via chemical vapor deposition"

2008 MRS Fall Meeting, Boston, USA (2008).

22. S. Tateyama, Y. Shibuta, T. Suzuki
"A molecular dynamics study of fcc-bcc phase transformation kinetices of iron"
2008 MRS Fall Meeting, Boston, USA (2008).

21. Y. Okajima, Y. Shibuta, T. Suzuki
"Electric current and electrode potential in phase-field modeling"
PRiME 2008(Pacific Rim Meeting on electrochemical and solid-state science), Hawaii, USA (2008).

20. J.A. Elliott, Y. Shibuta
"Multiscale modeling of early stage growth of CNTs produced by a catalytic CVD process"
APS March Meeting 2008, New Orleans, USA (2008).

19. Y. Shibuta, T. Suzuki
"A molecular dynamics study of the melting and nucleation of iron nanoparticles"
APS March Meeting 2008, New Orleans, USA (2008).


2007
18. Y. Onaka, K. Tani, Y. Takata, M. Kohno, S. Suzuki, S. Maruyama, Y. Shibuta
"Synthesis of single-walled carbon nanotubes by laser vaporized catalytic CVD technique"
9th International Conference on Laser Ablation (COLA 2007), Tenerife, Spain (2007).

17. J.A. Elliott, Y. Shibuta
"Multiscale model for the early stage growth of CNTs produced by a catalytic CVD process"
NT07, Ouro Preto, Brazil, (2007).

16. S. Yamamoto, K. Tani, Y. Onaka, Y. Takata, S. Suzuki, Y. Shibuta, S. Maruyama, M. Kohno
"Synthesis of single walled carbon nanotubes by laser vaporized catalytic
chemical vapor deposition technique"

2007 ASME-JSME Thermal Engineering Conference and Summer Heat Transfer Conference,
Vancouver, Canada (2007).


2006
15. Y. Okajima, Y. Shibuta, T. Suzuki
"Phase-field simulation of an electrodeposition process"
16th Iketani Conference, Tokyo, Japan (2006).

14. S. Hirama, Y. Shibuta, S. Maruyama
"Molecular Dynamics Simulation of a Nucleation Process of an SWNT in Alcohol
Catalytic CVD Technique"

NT06, Nagano, Japan, (2006).


2001-2005
13. S. Maruyama, Y. Shibuta
"Molecular Dynamics Simulation of Nucleation Process of Single-Walled Carbon Nanotubes"
Computational Challenges and Tools for Nanotubes, Gothenburg, Sweden (2005) .

12. Y. Shibuta, S. Maruyama
"Molecular Dynamics Simulation of Initial Nucleation Process of SWNT
from a Metal Particle on a Substrate"

NT05, Gothenburg, Sweden, (2005).

11. Y. Shibuta, S. Maruyama
"Molecular Dynamics Simulation of Nucleation Process of SWNT
from a Metal Particle on a Substrate"

Annual APS March Meeting 2005, Los Angels, USA (2005).

10. S. Maruyama, Y. Igarashi and Y. Shibuta
"Heat Transfer Problems related with Carbon Nanotubes by Molecular Dynamics-Based Simulations"
International Forum of Heat Transfer (IFHT2004), Kyoto, Japan (2004).

9. Y. Shibuta and S. Maruyama
"Molecular Dynamics study of Catalytic Ability of Transition Metals in Nucleation Process of SWNTs"
NT04, San Luis Potosho, Mexico (2004).

8. Y. Shibuta, S. Maruyama
"Molecular Dynamics Simulation of Nucleation Process of Single-Walled Carbon Nanotubes"
Annual APS March Meeting 2004, Montreal, Canada (2004).

7. S. Maruyama, Y. Igarashi, Y. Taniguchi and Y. Shibuta
"Molecular Dynamics Simulation of Heat Transfer Issues in Carbon Nanotubes"
1st Int. Sympo. Micro. Nano. Technol., Honolulu, USA (2004).

6. S. Maruyama, Y. Taniguchi and Y. Shibuta
"Characterization of Heat Conduction of Carbon Nanotube by Molecular Dynamics Method"
Eurotherm 75, Reims, France (2003).

5. Y. Shibuta and S. Maruyama,
"A Molecular Dynamics Simulation of Nucleation Process of SWNTs in CCVD Method"
6th ASME/JSME Thermal Engineering Joint Conference, Hawaii, USA (2003).

4. S. Maruyama and Y. Shibuta
"Molecular Dynamics Simulation of Nucleation and Growth of Single-Walled Carbon Nanotubes"
NASA/Rice SWNT Workshop, Boerne, USA (2003).

3. S. Maruyama and Y. Shibuta
"Molecular Dynamics Simulation of Generation Process of SWNTs"
Int. Sym. Nanocarbons, Nagano, Japan (2001) .

2. Y. Shibuta and S. Maruyama
"Molecular Dynamics Simulation of Generation Process of SWNTs"
Tsukuba Symposium on Carbon Nanotube in Commemoration of the 10th Anniversary of its Discovery,
Tsukuba (2001).

1. S. Maruyama, M. Kohno, T. Mukae, Y. Shibuta and S. Inoue
"FT-ICR Reaction Experiments and Molecular Dynamics Simulation of Precursor Cluster for SWNTs"
199th ECS Meeting, Washington D.C., USA, (2001).