arXiv subjects

Akira Yamaguchi

Publications and source records attributed to Akira Yamaguchi.

13 recordsLinked to original sources

arXiv2026

CBF-based Driving Assistance for Traffic Flow Stabilization

This manuscript addresses a hierarchical control system designed to suppress traffic congestion. The lower-layered controllers, implemented in each controlled vehicle, monitor microscopic vehicle behaviors and assist human drivers to ensure sufficient spacing for following vehicles. This spacing logic is designed based on the Control Barrier Function. Meanwhile, the upper-layered controller monitors the macroscopic traffic flow and activates the necessary lower-layered controllers, using a data-driven approach for the activation logic design. Furthermore, the effectiveness of the proposed control system is evaluated in a traffic flow simulation environment constructed using real-world traffic data.

eess.SY↗

arXiv2026

In situ U Pb chronology and chemistry of zirconolite in the andesitic meteorite Erg Chech 002

Precise and accurate ages for asteroidal crusts are fundamental for reconstructing the timeline of magmatic, metamorphic, and impact events in the early Solar System. Zirconolite (CaZrTi2O7) is an accessory mineral found in a wide range of crustal rocks on both the Earth and Moon, and has proven to be a potentially useful U Pb chronometer. However, this mineral is rare in asteroidal meteorites, and its use for early Solar System chronology has been limited. We present the in situ occurrence, U Pb chronology, and chemistry of zirconolite in the andesitic meteorite Erg Chech 002, which represents a sample of the oldest known asteroidal crust. The zirconolite occurs as needle- and fiber-shaped, stubby crystals, with widths of 3 micrometers and lengths of up to 30 micrometers. Electron and ion microprobe analyses yielded concordant U Pb data with a weighted mean 207Pb 206Pb age of 4557.9 4.3 Ma 2sigma, rendering it the Solar System's oldest known zirconolite. Yet, this age is distinctly younger than reported high-precision 207Pb 206Pb ages varying from 4565.6 to 4566.2 Ma, which were obtained by acid leaching of pyroxene and whole rock samples of the meteorite. From its mineralogical and REE (U+Th) (Nb+Ta) characteristics, we argue that the zirconolite age represents the timing of a shock metamorphism of the parent asteroid's crust. Our results suggest that 207Pb 206Pb dating for acid-leached samples can be affected by including even a tiny amount of metamorphic zirconolite, calling for caution in interpreting the high-precision 207Pb 206Pb age data. On the basis of thermodynamic and geochemical considerations, we infer further occurrences of zirconolite in alkali-silica-rich asteroidal rocks that rapidly cooled from high temperatures.

physics.geo-ph↗

arXiv2025

Phonon density of states of silica (SiO2) nanopore via molecular dynamics simulations

This study presents a comprehensive computational investigation of the vibration density of states (VDOS) of a silica nanopore, systematically evaluating a range of force fields against inelastic neutron scattering results. We analyze the influence of temperature, crustal structure, and surface-adsorbed water molecules on the nanopore's structural and dynamic properties. We performed classical molecular dynamics simulations of nanopore and bulk silica, and used density functional theory (DFT) calculations for bulk silica for comparison. The resulting VDOS shows relatively good agreement with DFT and experimental data. The temperature has a relatively low effect on the dry nanopore. The inclusion of H2O molecules significantly affects the VDOS. The low-energy modes are dominated by H2O VDOS and increase with loading. This work is an essential step towards characterizing silica nanopores via molecular dynamics and provides a valuable reference for experimental comparison with X-ray and neutron scattering VDOS results.

cond-mat.mtrl-sci↗

arXiv2025

Growth of uniform helium submonolayers adsorbed on single-surface graphite observed by surface X-ray diffraction

We observed surface X-ray diffraction from He-4 submonolayers adsorbed on a single-surface graphite using synchrotron X-rays. Time evolutions of scattering intensities along the crystal truncation rod (CTR) were observed even after reaching the base low temperature in a selected condition of sample preparation. Our simulations for CTR scatterings based on the random double-layer model, in which helium atoms are distributed randomly in the first and second layers with a certain occupancy ratio, can consistently explain the observed intensity changes. These results support the scenario that He atoms are stratified initially as a nonequilibrium state and then relaxed into a uniform monolayer by surface diffusion, where the relaxation process was observed as a decrease in CTR scattering intensity. The observed time constant was, however, much longer than those estimated from quantum and thermal surface diffusions. This implies homogeneous processes in surface diffusions were strongly suppressed by local potentials in such as atomic steps or microcrystalline boundaries.

cond-mat.mtrl-sci↗

arXiv2024

A cost-effective strategy of enhancing machine learning potentials by transfer learning from a multicomponent dataset on ænet-PyTorch

Machine learning potentials (MLPs) offer efficient and accurate material simulations, but constructing the reference ab initio database remains a significant challenge, particularly for catalyst-adsorbate systems. Training an MLP with a small dataset can lead to overfitting, thus limiting its practical applications. This study explores the feasibility of developing computationally cost-effective and accurate MLPs for catalyst-adsorbate systems with a limited number of ab initio references by leveraging a transfer learning strategy from subsets of a comprehensive public database. Using the Open Catalyst Project 2020 (OC20) -- a dataset closely related to our system of interest -- we pre-trained MLP models on OC20 subsets using the ænet-PyTorch framework. We compared several strategies for database subset selection. Our findings indicate that MLPs constructed via transfer learning exhibit better generalizability than those constructed from scratch, as demonstrated by the consistency in the dynamics simulations. Remarkably, transfer learning enhances the stability and accuracy of MLPs for the CuAu/H2O system with approximately 600 reference data points. This approach achieved excellent extrapolation performance in molecular dynamics (MD) simulations for the larger CuAu/6H2O system, sustaining up to 250 ps, whereas MLPs without transfer learning lasted less than 50 ps. We also examine the potential limitations of this strategy. This work proposes an alternative, cost-effective approach for constructing MLPs for the challenging simulation of catalytic systems. Finally, we anticipate that this methodology will pave the way for broader applications in material science and catalysis research, facilitating more efficient and accurate simulations across various systems.

cond-mat.dis-nn↗

arXiv2022

Simulations of Surface X-ray Diffraction from a Monolayer 4He Film Adsorbed on Graphite

We carried out simulations of crystal truncation rod (CTR) scatterings, i.e., one of the surface X-ray diffraction techniques with atomic resolution, from a monolayer He film adsorbed on graphite. Our simulations reveal that the 00L rod scatterings from the He monolayer exhibit notable intensity modifications for those from a graphite surface in the ranges of approximately L = 0.6 - 1.7 and L = 2.2 - 3.5. The height of the He monolayer from the graphite surface largely affects the CTR scattering profiles, indicating that CTR scatterings have enough sensitivities to determine the surface structure of the various phases in the He layer. In particular, in the incommensurate solid phase, our preliminary experimental data show the intensity modulations that are expected from the present simulations.

cond-mat.other↗

arXiv2022

Hydrothermal activities on C-complex asteroids induced by radioactivity

C-complex asteroids, rich in carbonaceous materials, are potential sources of Earth's volatile inventories. They are spectrally dark resembling primitive carbonaceous meteorites, and thus, C-complex asteroids are thought to be potential parent bodies of carbonaceous meteorites. However, the substantial number of C-complex asteroids exhibits surface spectra with weaker hydroxyl absorption than water-rich carbonaceous meteorites. Rather, they best correspond to meteorites showing evidence for dehydration, commonly attributed to impact heating. Here, we report an old radiometric age of 4564.7 million years ago for Ca-carbonates from the Jbilet Winselwan meteorite analogous to dehydrated C-complex asteroids. The carbonates are enclosed by a high-temperature polymorph of Ca-sulfates, suggesting thermal metamorphism at >300°C subsequently after aqueous alteration. This old age indicates the early onset of aqueous alteration and subsequent thermal metamorphism driven by the decay of short-lived radionuclides rather than impact heating. The breakup of original asteroids internally heated by radioactivity should result in asteroid families predominantly consisting of thermally metamorphosed materials. This explains the common occurrence of dehydrated C-complex asteroids.

astro-ph.EP↗

arXiv2021

Structural Study of Adsorbed Helium Films: New Approach with Synchrotron Radiation X-rays

A few atomic layers of helium adsorbed on graphite have been attracting much attention as one of the ideal quantum systems in two dimension. Although previous reports on neutron diffraction have shown fundamental structural information in these systems, there still remain many open questions. Here, we propose surface crystal truncation rod (CTR) scatterings using synchrotron radiation X-rays as a promising method to reveal surface and interface structures of helium films on graphite at temperatures below 2 K, based on the preliminary experimental results on a monolayer of He-4 on a thin graphite. Our estimation on heat generation by X-ray irradiations also suggests that CTR scatterings are applicable to even at system temperatures near 100 mK.

cond-mat.other↗

arXiv2021

Tuning the intermediate reaction barriers by CuPd catalyst to improve the selectivity of electroreduction CO2 to C2 products

Electrochemical CO2 reduction is a promising strategy for utilization of CO2 and intermittent excess electricity. Cu is the only single-metal catalyst that can electrochemically convert CO2 to multi-carbon products. However, Cu has an undesirable selectivity and activity for C2 products, due to its insufficient amount of CO* for C-C coupling. Considering the strong CO2 adsorption and ultra-fast reaction kinetics of CO* formation on Pd, an intimate CuPd(100) interface was designed to lower the intermediate reaction barriers and then improve the efficiency of C2 products. Density functional theory (DFT) calculations showed that the CuPd(100) interface has enhanced CO2 adsorption and decreased CO2* hydrogenation energy barrier, which are beneficial for C-C coupling. The potential-determining step (PDS) barrier of CO2 to C2 products on CuPd(100) interface is 0.61 eV, which is lower than that on Cu(100) (0.72 eV). Motivated by the DFT calculation, the CuPd(100) interface catalyst was prepared by a facile chemical solution method and demonstrated by transmission electron microscope (TEM). The CO2 temperature programmed desorption (CO2-TPD) and gas sensor experiments proved the enhancements of CO2 adsorption and CO2* hydrogenation abilities on CuPd(100) interface catalyst. As a result, the obtained CuPd(100) interface catalyst exhibits a C2 Faradaic efficiency of 50.3 (+/-) 1.2% at -1.4 VRHE in 0.1 M KHCO3, which is 2.1 times higher than 23.6(+/-) 1.5% of Cu catalyst. This work provides a rational design of Cu-based electrocatalyst for multi-carbon products by fine-tuning the intermediate reaction barriers.

cond-mat.mtrl-sci↗

arXiv2021

A 4565 Myr old andesite from an extinct chondritic protoplanet

The age of iron meteorites implies that accretion of protoplanets began during the first millions of years of the solar system. Due to the heat generated by 26Al decay, many early protoplanets were fully differentiated with an igneous crust produced during the cooling of a magma ocean and the segregation at depth of a metallic core. The formation and nature of the primordial crust generated during the early stages of melting is poorly understood, due in part to the scarcity of available samples. The newly discovered meteorite Erg Chech 002 (EC 002) originates from one such primitive igneous crust and has an andesite bulk composition. It derives from the partial melting of a noncarbonaceous chondritic reservoir, with no depletion in alkalis relative to the Sun photosphere and at a high degree of melting of around 25 percents. Moreover, EC 002 is, to date, the oldest known piece of an igneous crust with a 26Al-26Mg crystallization age of 4,565.0 million years (My). Partial melting took place at 1,220 C up to several hundred kyr before, implying an accretion of the EC 002 parent body ca. 4,566 My ago. Protoplanets covered by andesitic crusts were probably frequent. However, no asteroid shares the spectral features of EC 002, indicating that almost all of these bodies have disappeared, either because they went on to form the building blocks of larger bodies or planets or were simply destroyed.

astro-ph.EP↗

arXiv2021

Mesosiderite formation on asteroid 4 Vesta by a hit-and-run collision

Collision and disruption processes of proto-planetary bodies in the early solar system are key to understanding the genesis of diverse types of main-belt asteroids. Mesosiderites are stony-iron meteorites that formed by mixing of howardite-eucrite-diogenite-like crust and molten core materials and provide unique insights into the catastrophic break-up of differentiated asteroids. However, the enigmatic formation process and the poorly constrained timing of metal-silicate mixing complicate the assignment to potential parent bodies. Here we report high-precision uranium-lead dating of mesosiderite zircons by isotope dilution thermal ionization mass spectrometry, revealing initial crust formation 4,558.5 +/- 2.1 million years ago and metal-silicate mixing at 4,525.39 +/- 0.85 million years. The two distinct ages coincide with the timing of crust formation and a large-scale reheating event on the eucrite parent body, likely the asteroid Vesta. This chronological coincidence corroborates that Vesta is the parent body of mesosiderite silicates. Mesosiderite formation on Vesta can be explained by a hit-and-run collision 4,525.4 million years ago that caused the thick crust observed by NASA's Dawn mission and explains the missing olivine in mesosiderites, howardite-eucrite-diogenite meteorites, and vestoids.

astro-ph.EP↗

arXiv2020

Magnetoelectric Effect in the Antiferromagnetic Ordered State of Ce$_{3}$TiBi$_{5}$ with Ce Zig-Zag Chains

In this study, we investigate the magnetoelectric (ME) effect of the newly discovered antiferromagnetic (AFM) compound Ce$_{3}$TiBi$_{5}$ with a hexagonal structure (space group $P6_{3}$/$mcm$). In this system, Ce ions form zig-zag chains that extend along the $c$-axis. We focus on the lack of the local inversion symmetry at the Ce site, although the crystal structure has an inversion center. A theoretical study has predicted that magnetization can be induced by an electric current in the AFM ordering on the zig-zag chain. We conducted magnetization measurements on Ce$_{3}$TiBi$_{5}$ under an applied constant electric current and a static magnetic field around the AFM ordering temperature of $T_{\rm N}$ = 5.0 K. We successfully observed of the current-induced magnetization below $T_{\rm N}$. The magnitude of the current-induced magnetization has a linear electric current dependence and exhibits no magnetic field dependence. This behavior is consistent with the theoretical prediction of the ME effect in the ferrotoroidal ordered state.

cond-mat.str-el↗

arXiv2001

Mixed-Valence Tetranuclear Manganese Single-Molecule Magnets

The preparations, X-ray structures, and detailed physical characterizations are presented for two new mixed-valence tetranuclear manganese complexes that function as single-molecule magnets (SMM's): [Mn4(hmp)6Br2(H2O)2]Br2.4H2O and [Mn4(6-me-hmp)6Cl4].4H2O, where hmp- is the anion of 2-hydroxymethylpyridine and 6-me-hmp- is the anion of 6-methyl-2-hydroxymethylpyridine.

cond-mat↗