Itami Toshio

Dr. Itami Toshio


Research Focus & Metrics

Academic Career Length

25Years (2002-Present)

(Calculated once Scilit publication data is synced: current year − year of first publication + 1)

Representative Publications

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12 September 2002 in Journal of Non-Crystalline Solids
Verified
Journal Article
Closed access
ITItami Toshio
Itami Toshio
TMT. Masaki
T. Masaki
HAH. Aoki
H. Aoki
SMS. Munejiri
S. Munejiri
MUM. Uchida
M. Uchida
KHK. Hoshino
K. Hoshino

18 January 2008 in Physical Review B
Verified
Journal Article
Closed access
PDF file
SMS. Munejiri
S. Munejiri
TMT. Masaki
T. Masaki
ITItami Toshio
Itami Toshio
FSF. Shimojo
F. Shimojo
KHK. Hoshino
K. Hoshino
The first-principles molecular-dynamics simulation was performed for liquid Ge at 1253K by using two kinds of simulation cells: The cubic cell of 64 atoms and the rectangular parallelepiped one of 128 atoms. The rectangular parallelepiped cell of 128 atoms was adopted to obtain the dynamic structure factor of liquid Ge in the small wave number region. The long simulation time was adopted, i.e., 66ps for the cubic cell and 75ps for the rectangular parallelepiped one. The present first-principles molecular-dynamics simulation reproduces well the experimental static structure factor and radial distribution function. A broad peak around 100° in the obtained bond angle distribution function implies the existence of the tetrahedral atomic unit in liquid Ge. The self-diffusion coefficient for the rectangular parallelepiped cell is 20% larger than that of the cubic one. The obtained dynamic structure factor agrees well with the experimental one obtained by the inelastic x-ray scattering experiment [Hosokawa et al., Phys. Rev. B 63, 134205 (2001)], which shows the “de Gennes narrowing” of the main peak and the existence of the side peaks. These side peaks represent a longitudinal vibrational motion, which was also supported by the subsidiary peak around 30ps−1 in the spectral density of the velocity autocorrelation function. The gradient of the dispersion relation in the present simulation agrees well with the experimental sound velocity. This “no positive dispersion” accords well with the inelastic x-ray scattering experiment of Hosokawa et al. The reason for this “no positive dispersion” for liquid Ge is discussed in particular concern with its low kinematic viscosity. Though the velocity autocorrelation function itself does not show a cage effect, a microscopic cage effect can be found by the detailed analysis for the trace and environment of the single atomic motion. The atomic movement as a group of 3–5 atoms seems to be present in liquid Ge in addition to individual atomic motions. The covalent bond seems to be also present at least instantaneously in liquid Ge.

1 October 2007 in Journal of Non-Crystalline Solids
Verified
Journal Article
Closed access
ITItami Toshio
Itami Toshio
HAHirokatsu Aoki
Hirokatsu Aoki
TSTakeru Shibata
Takeru Shibata
MIMotoshige Ikeda
Motoshige Ikeda
KHKoichi Hotozuka
Koichi Hotozuka

1 October 2007 in Journal of Non-Crystalline Solids
Verified
Journal Article
Closed access
AMA. Mizuno
A. Mizuno
ITItami Toshio
Itami Toshio
GFG. Ferlat
G. Ferlat
ASAlfonso San-Miguel
Alfonso San-Miguel
JJJ.F. Jal
J.F. Jal

12 September 2002 in Journal of Non-Crystalline Solids
Verified
Journal Article
Closed access
AMA Mizuno
A Mizuno
ITItami Toshio
Itami Toshio
ASAlfonso San-Miguel
Alfonso San-Miguel
GFG Ferlat
G Ferlat
JJJ.F Jal
J.F Jal
MBM Borowski
M Borowski

14 July 2015 in Metals
Verified
Journal Article
Open access
PDF file
ITItami Toshio
Itami Toshio
JSJunichi Saito
Junichi Saito
KAKuniaki Ara
Kuniaki Ara
A new kind of suspension liquid was developed by dispersing Ti nanoparticles (10 nm) in liquid Na, which was then determined by TEM (transmission electron microscopy) analysis. The volume fraction was estimated to be 0.0088 from the analyzed Ti concentration (2 at. %) and the densities of Ti and Na. This suspension liquid, Liquid Sodium containing nanoparticles of titanium (LSnanop), shows, despite only a small addition of Ti nanoparticles, many striking features, namely a negative deviation of 3.9% from the ideal solution for the atomic volume, an increase of 17% in surface tension, a decrease of 11% for the reaction heat to water, and the suppression of chemical reactivity to water and oxygen. The decrease in reaction heat to water seems to be derived from the existence of excess cohesive energy of LSnanop. The excess cohesive energy was discussed based on simple theoretical analyses, with particular emphasis on the screening effect. The suppression of reactivity is discussed with the relation to the decrease of heat of reaction to water or the excess cohesive energy, surface tension, the action as a plug of Ti oxide, negative adsorption on the surface of LSnanop, and percolation.