Numerical simulation of coupled THM behaviour of full-scale EBS in backfilled experimental gallery in the Horonobe URL

Sugita, Yutaka; Ono, Hirokazu; Beese, S.*; Pan, P.*; Kim, M.*; Lee, C.*; Jove-Colon, C.*; Lopez, C. M.*; Liang, S.-Y.*

Geomechanics for Energy and the Environment, 42, p.100668_1 - 100668_21, 2025/06

https://doi.org/10.1016/j.gete.2025.100668

The international cooperative project DECOVALEX 2023 focused on the Horonobe EBS experiment in the Task D, which was undertaken to study, using numerical analyses, the thermo-hydro-mechanical (or thermo-hydro) interactions in bentonite based engineered barriers. One full-scale in-situ experiment and four laboratory experiments, largely complementary, were selected for modelling. The Horonobe EBS experiment is a temperature-controlled non-isothermal experiment combined with artificial groundwater injection. The Horonobe EBS experiment consists of the heating and cooling phases. Six research teams performed the THM or TH (depended on research team approach) numerical analyses using a variety of computer codes, formulations and constitutive laws.

Gapless dispersive continuum in a modulated quantum kagome antiferromagnet

Thennakoon, A.*; Yokokura, Ryoga*; Yang, Y.*; Kajimoto, Ryoichi; Nakamura, Mitsutaka; Hayashi, Masahiro*; Michioka, Chishiro*; Chern, G.-W.*; Broholm, C.*; Ueda, Hiroaki*; et al.

Nature Communications (Internet), 16, p.3939_1 - 3939_13, 2025/04

https://doi.org/10.1038/s41467-025-58971-4

The Influence of structural dynamics in two-dimensional hybrid organic-inorganic perovskites on their photoluminescence efficiency; Neutron scattering analysis

Rajeev, H. S.*; Hu, X.*; Chen, W.-L.*; Zhang, D.*; Chen, T.*; Kofu, Maiko*; Kajimoto, Ryoichi; Nakamura, Mitsutaka; Chen, A. Z.*; Johnson, G. C.*; et al.

Journal of the Physical Society of Japan, 94(3), p.034602_1 - 034602_14, 2025/03

https://doi.org/10.7566/JPSJ.94.034602

A Lightweight shape-memory alloy with superior temperature-fluctuation resistance

Song, Y.*; Xu, S.*; Sato, Shunsuke*; Lee, I.*; Xu, X.*; Omori, Toshihiro*; Nagasako, Makoto*; Kawasaki, Takuro; Kiyanagi, Ryoji; Harjo, S.; et al.

Nature, 638, p.965 - 971, 2025/02

https://doi.org/10.1038/s41586-024-08583-7

Novel approach to explore hydrogen trapping sites in aluminum; Integrating Muon spin relaxation with first-principles calculations

Shimizu, Kazuyuki*; Nishimura, Katsuhiko*; Matsuda, Kenji*; Nunomura, Norio*; Namiki, Takahiro*; Tsuchiya, Taiki*; Akamaru, Satoshi*; Lee, S.*; Tsuru, Tomohito; Higemoto, Wataru; et al.

International Journal of Hydrogen Energy, 95, p.292 - 299, 2024/12

https://doi.org/10.1016/j.ijhydene.2024.11.265

Zero-field muon spin relaxation experiments were conducted on Al-0.06%Mn, Al-0.06%Cr, Al-0.02%Fe, and Al-0.02%Ni alloys (at.%) across the temperature ranging from 5 to 300 K. The temperature-dependent variations of the dipole field widths () elucidated four distinct peaks for the prepared alloys. Atomic configurations of the muon trapping sites corresponding to the observed peaks below 200 K were meticulously characterized utilizing first-principles calculations for the trapping energies of hydrogen in proximity to a solute and solute-vacancy pair. This comprehensive analysis facilitated the establishment of a linear correlation between the muon peak temperature and the hydrogen trapping energy. However, significant deviations from this linear relationship were observed for the fourth peaks above 200 K in Al-Mn, Al-Cr, Al-Fe, and Al-Ni alloys. This discrepancy can be interpreted by considering the disparate distribution functions of muon and hydrogen within the tetrahedral site, wherein two of the four Al atoms are substituted by the solute element and vacancy (solute-vacancy pair).

Magnetic excitation in the hyperkagome antiferromagnet MnRhSi

Shamoto, Shinichi; Yamauchi, Hiroki; Iida, Kazuki*; Ikeuchi, Kazuhiko*; Kaneko, Koji; Chen, Y.-S.*; Yano, Shinichiro*; Hsu, P.-T.*; Lee, M. K.*; Hall, A. E.*; et al.

Physical Review Research (Internet), 6(3), p.033303_1 - 033303_7, 2024/09

https://doi.org/10.1103/PhysRevResearch.6.033303

The magnetic excitation extends at least from 0.3 to 140 meV. The integrated inelastic scattering intensity leads to a localized magnetic moment of about 5 per Mn site fluctuating at 200 K in the wide energy range, although the long-range ordered magnetic moment is only 2.61 at 4 K. The result suggests that a large part of the magnetic moment does not order in MnRhSi.

Morphology evolution of -phase in Al-Mg-Si alloys during aging treatment

Ahmed, A.*; Uttarasak, K.*; Tsuchiya, Taiki*; Lee, S.*; Nishimura, Katsuhiko*; Nunomura, Norio*; Shimizu, Kazuyuki*; Hirayama, Kyosuke*; Toda, Hiroyuki*; Yamaguchi, Masatake; et al.

Journal of Alloys and Compounds, 988, p.174234_1 - 174234_9, 2024/06

https://doi.org/10.1016/j.jallcom.2024.174234

This study aims to clarify the growth process of the-phase in Al-Mg-Si alloys from the point of view of morphology evolution. For this research, the -phase orientation relationship, shape, growth process, misfit value, and interfacial condition between the -phase and Al matrix were investigated using high-resolution transmission electron microscopy (HR-TEM), focus ion beam (FIB), and optical microscope (OM). Results include the identification of {111} facets at the edges of the -phase, as well as the proposal of two new three-dimensional shapes for the -phase. We purposed the morphology evolution during the growth process of MgSi crystal and calculated the misfit to understand the unstable (111) facet has a higher misfit value as compared to the (001) and (011) facets. Our observations provide how they influence the behavior of MgSi crystals.

In-situ neutron diffraction study of serration-involved ultra-cryogenic deformation behavior at 15 K

Kim, Y. S.*; Chae, H.*; Lee, D.-Y.*; Han, J. H.*; Hong, S.-K.*; Na, Y. S.*; Harjo, S.; Kawasaki, Takuro; Woo, W.*; Lee, S.-Y.*

Materials Science & Engineering A, 899, p.146453_1 - 146453_7, 2024/05

https://doi.org/10.1016/j.msea.2024.146453

Combining muon spin relaxation and DFT simulations of hydrogen trapping in AlMn

Shimizu, Kazuyuki*; Nishimura, Katsuhiko*; Matsuda, Kenji*; Akamaru, Satoshi*; Nunomura, Norio*; Namiki, Takahiro*; Tsuchiya, Taiki*; Lee, S.*; Higemoto, Wataru; Tsuru, Tomohito; et al.

Scripta Materialia, 245, p.116051_1 - 116051_6, 2024/05

https://doi.org/10.1016/j.scriptamat.2024.116051

Hydrogen at the mass ppm level causes hydrogen embrittlement in metallic materials, but it is extremely difficult to experimentally elucidate the hydrogen trapping sites. We have taken advantage of the fact that positive muons can act as light isotopes of hydrogen to study the trapping state of hydrogen in matter. Zero-field muon spin relaxation experiments and the density functional theory (DFT) calculations for hydrogen trapping energy are carried out for AlMn. The DFT calculations for hydrogen in AlMn have found four possible trapping sites in which the hydrogen trapping energies are 0.168 (site 1), 0.312 (site 2), 0.364 (site 3), and 0.495 (site 4) in the unit of eV/atom. Temperature variations of the deduced dipole field width () indicated step-like changes at temperatures, 94, 193, and 236 K. Considering their site densities, the observed change temperatures are interpreted by trapping muons at sites 1, 3, and 4.

Quantum critical behavior of the hyperkagome magnet MnCoSi

Yamauchi, Hiroki; Sari, D. P.*; Yasui, Yukio*; Sakakura, Terutoshi*; Kimura, Hiroyuki*; Nakao, Akiko*; Ohara, Takashi; Honda, Takashi*; Kodama, Katsuaki; Igawa, Naoki; et al.

Physical Review Research (Internet), 6(1), p.013144_1 - 013144_9, 2024/02

https://doi.org/10.1103/PhysRevResearch.6.013144