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Journal Articles

Nanoscale structural analysis of Bi$$_{0.5}$$Na$$_{0.5}$$TiO$$_3$$

Yoneda, Yasuhiro; Noguchi, Yuji*

Japanese Journal of Applied Physics, 59(SP), p.SPPA01_1 - SPPA01_7, 2020/11

 Times Cited Count:0

We investigate A-site cation ordering in the ferroelectric perovskite Bi$$_{0.5}$$Na$$_{0.5}$$TiO$$_3$$ (BNT) by synchrotron X-ray total scattering. Although BNT has a problem of a low depolarization temperature, it is promising a lead-free piezoelectric material. Since the depolarization temperature is presumed to correspond to a relaxer like gradual order-disorder phase transition, local structure analysis is necessary to understand the structure of the diorder phase. Through this approach, the elusive connection between chemical heterogeneity and structural heterogeneity is revealed. Because of the large randomness, the Ti off-center shift is averaged out beyond the unit cell and the structure becomes very close to the average structure beyond the unit cell.

Journal Articles

Development and application of a $$^3$$He neutron spin filter at J-PARC

Okudaira, Takuya; Oku, Takayuki; Ino, Takashi*; Hayashida, Hirotoshi*; Kira, Hiroshi*; Sakai, Kenji; Hiroi, Kosuke; Takahashi, Shingo*; Aizawa, Kazuya; Endo, Hitoshi*; et al.

Nuclear Instruments and Methods in Physics Research A, 977, p.164301_1 - 164301_8, 2020/10

Journal Articles

Neutron diffraction monitoring of ductile cast iron under cyclic tension-compression

Harjo, S.; Kubota, Satoru*; Gong, W.*; Kawasaki, Takuro; Gao, S.*

Acta Materialia, 196, p.584 - 594, 2020/09

 Times Cited Count:0

Journal Articles

Practical effects of pressure-transmitting media on neutron diffraction experiments using Paris-Edinburgh presses

Hattori, Takanori; Sano, Asami; Machida, Shinichi*; Ouchi, Keiichi*; Kira, Hiroshi*; Abe, Jun*; Funakoshi, Kenichi*

High Pressure Research, 40(3), p.325 - 338, 2020/09

 Times Cited Count:0 Percentile:100(Physics, Multidisciplinary)

To understand the practical effects of pressure-transmitting media (PTM) on neutron diffraction using Paris-Edinburgh presses, diffraction patterns of MgO were collected to approximately 20 GPa using PTMs of Pb, AgCl, 4:1 methano-ethanol (ME) mixture with and without heating, N$$_2$$, and Ar. Hydrostaticity in the sample chamber estimated from the MgO 220 peak width improves in the order of Pb, AgCl, Ar, ME mixture, N$$_2$$, and the heated ME mixture. Unlike previous results using a diamond anvil cell, the unheated ME mixture is superior to Ar even after freezing, probably due to the cup on the anvil face. Considering these results and the sizable coherent scattering of Ne, which would show good hydrostaticity, we conclude that the ME mixture (preferably the heated one) is the best PTM in neutron experiments up to 20 GPa, while Ar can be substituted when a sample is reactive to alcohols.

Journal Articles

Local structure investigations of accumulated damage in irradiated MgAl$$_{2}$$O$$_{4}$$

Yoshioka, Satoru*; Tsuruta, Konosuke*; Yamamoto, Tomokazu*; Yasuda, Kazuhiro*; Matsumura, Sho*; Sugiyama, Takeharu*; Oba, Yojiro; Ishikawa, Norito; Kobayashi, Eiichi*; Okudaira, Koji*

Journal of the American Ceramic Society, 103(8), p.4654 - 4663, 2020/08

 Times Cited Count:0 Percentile:100(Materials Science, Ceramics)

X-ray absorption near edge structure (XANES) and small-angle X-ray scattering (SAXS) reveal the damaged structures in MgAl$$_{2}$$O$$_{4}$$ spinel induced by swift heavy ions. SAXS indicates the formation of ion tracks with cylindrical shape with a diameter of 5 nm. XANES indicates the cationic disordering between tetrahedral and octahedral sites by the irradiation. Quantitative analysis of XANES also reveals that cations preferably occupy the octahedral sites at high fluence.

Journal Articles

Unveiling spin-dependent unoccupied electronic states of Co$$_{2}$$MnGe (Ga) film via Ge (Ga) $$L_{2,3}$$ absorption spectroscopy

Yoshikawa, Tomoki*; Antonov, V. N.*; Kono, Takashi*; Kakoki, Masaaki*; Sumida, Kazuki; Miyamoto, Koji*; Takeda, Yukiharu; Saito, Yuji; Goto, Kazuki*; Sakuraba, Yuya*; et al.

Physical Review B, 102(6), p.064428_1 - 064428_7, 2020/08

Journal Articles

Nature of the Dirac gap modulation and surface magnetic interaction in axion antiferromagnetic topological insulator MnBi$$_{2}$$Te$$_{4}$$

Shikin, A. M.*; Estyunin, D. A.*; Klimovskikh, I. I.*; Filnov, S. O.*; Kumar, S.*; Schwier, E. F.*; Miyamoto, Koji*; Okuda, Taiichi*; Kimura, Akio*; Kuroda, Kenta*; et al.

Scientific Reports (Internet), 10, p.13226_1 - 13226_13, 2020/08

Journal Articles

Nanostructural characterization of oleyl acid phosphate in poly-$$alpha$$-olefin using small-angle X-ray scattering

Oba, Yojiro; Motokawa, Ryuhei; Hino, Masahiro*; Adachi, Nozomu*; Todaka, Yoshikazu*; Inoue, Rintaro*; Sugiyama, Masaaki*

Chemistry Letters, 49(7), p.823 - 825, 2020/07

 Times Cited Count:0 Percentile:100(Chemistry, Multidisciplinary)

Journal Articles

$$f$$-electron states of NpPd$$_5$$Al$$_2$$ and the isostructural family; Heavy fermion superconductivity accompanied by valence crossover

Metoki, Naoto

Kotai Butsuri, 55(7), p.285 - 296, 2020/07

Electron states are the main theme of "solid-state physics", which is essential for microscopic understanding of multipoles and superconductivity, etc. Rare earths (4$$f$$) and actinides (5$$f$$) provide variety of interesting states realized with competing interactions between the increasing number of $$f$$ electrons. Since crystal field splitting of many-body $$f$$ electron system is smaller than the bandwidth, (1) high resolution experiments are needed, (2) essentially no clear spectrum with well defined peaks is expected in itinerant Ce and U compounds, and (3) Np and Pu is strictly regulated. Therefore, systematic research on magnetic excitations by neutron scattering experiments of localized compounds and rare earth iso-structural reference is useful. We describe the $$f$$ electron states of heavy electron compounds NpPd$$ _5$$Al$$_2$$ and actinide and rare earth based iso-structural family.

Journal Articles

Structural, magnetic, transport, and thermoelectric properties of the pseudobrookite AlTi$$_{2}$$O$$_{5}$$-Ti$$_{3}$$O$$_{5}$$ system

Takahama, Ryusei*; Ishii, Toi*; Indo, Daigo*; Arizono, Mitsutoshi*; Terakura, Chieko*; Tokura, Yoshinori*; Takeshita, Nao*; Noda, Masaaki*; Kuwahara, Hideki*; Saiki, Takuo*; et al.

Physical Review Materials (Internet), 4(7), p.074401_1 - 074401_11, 2020/07

 Times Cited Count:0 Percentile:100(Materials Science, Multidisciplinary)

Journal Articles

Understanding water-mediated DNA damage production by molecular dynamics calculation of solvent accessibility

Yonetani, Yoshiteru*; Nakagawa, Hiroshi

Chemical Physics Letters, 749, p.137441_1 - 137441_5, 2020/06

 Times Cited Count:0 Percentile:100(Chemistry, Physical)

We calculated solvent accessibility of DNA backbone hydrogen sites, H1'-H5' by using molecular dynamics simulation of DNA. The result of accessibility is well correlated with the site-dependent reactivity with OH radicals experimentally reported, indicating that the different DNA-radical reactivity is mainly caused by the difference in the solvent accessibility of each hydrogen site. Compared with the previous calculation with solvent-accessible surface area, the present MD-based counting of molecular access provided a slightly improved result, which suggests importance of more realistic molecular components such as electrostatic interactions and DNA conformational fluctuation.

Journal Articles

Comparative studies of three-dimensional analysis and measurement for establishing pulse electromagnet design

Takayanagi, Tomohiro; Ueno, Tomoaki*; Horino, Koki*; Ono, Ayato; Yamamoto, Kazami; Kinsho, Michikazu

IEEE Transactions on Applied Superconductivity, 30(4), p.4901605_1 - 4901605_5, 2020/06

 Times Cited Count:0 Percentile:100(Engineering, Electrical & Electronic)

Journal Articles

Neutron diffraction study on the deuterium composition of nickel deuteride at high temperatures and high pressures

Saito, Hiroyuki*; Machida, Akihiko*; Hattori, Takanori; Sano, Asami; Funakoshi, Kenichi*; Sato, Toyoto*; Orimo, Shinichi*; Aoki, Katsutoshi*

Physica B; Physics of Condensed Matter, 587, p.412153_1 - 412153_6, 2020/06

 Times Cited Count:0 Percentile:100(Physics, Condensed Matter)

The site occupancy of deuterium (D) atoms in face-centered-cubic nickel (fcc Ni) was measured along a cooling path from 1073 to 300 K at an initial pressure of 3.36 GPa via in situ neutron powder diffraction. Deuterium atoms predominantly occupy the octahedral (O) sites and slightly occupy the tetrahedral (T) sites of the fcc metal lattice. The O-site occupancy increases from 0.4 to 0.85 as the temperature is lowered from 1073 to 300 K. Meanwhile, the T-site occupancy remains c.a. 0.02. The temperature-independent behavior of the T-site occupancy is unusual, and its process is not yet understood. From the linear relation between the expanded lattice volume and D content, a D-induced volume expansion of 2.09(13) $AA $^{3}$$/D atom was obtained. This value is in agreement with the values of 2.14-2.2 $AA $^{3}$$/D atom previously reported for Ni and Ni$$_{0.8}$$ Fe$$_{0.2}$$ alloy.

Journal Articles

Evidence for magnon-phonon coupling in the topological magnet Cu$$_{3}$$TeO$$_{6}$$

Bao, S.*; Cai, Z.*; Si, W.*; Wang, W.*; Wang, X.*; Shangguan, Y.*; Ma, Z.*; Dong, Z.-Y.*; Kajimoto, Ryoichi; Ikeuchi, Kazuhiko*; et al.

Physical Review B, 101(21), p.214419_1 - 214419_8, 2020/06

 Times Cited Count:0 Percentile:100(Materials Science, Multidisciplinary)

Journal Articles

Multi-methodical study of the Ti, Fe$$^{2+}$$ and Fe$$^{3+}$$ distribution in chevkinite-subgroup minerals; X-ray diffraction, neutron diffraction, $$^{57}$$Fe M$"o$ssbauer spectroscopy and electron-microprobe analyses

Nagashima, Mariko*; Armbruster, T.*; Akasaka, Masahide*; Sano, Asami; Nishio-Hamane, Daisuke*; Malsy, A.*; Imaoka, Teruyoshi*; Nakashima, Kazuo*

Physics and Chemistry of Minerals, 47(6), p.29_1 - 29_18, 2020/06

 Times Cited Count:0 Percentile:100(Materials Science, Multidisciplinary)

Three non-metamict chevkinite-subgroup minerals, from Cape Ashizuri, Japan, Tangir Valley, Diamar District, Pakistan and Haramosh Mts., Skardu district, Pakistan, were studied by crystal chemical techniques. Powder X-ray diffraction and transmission electron microscopic observations confirmed well crystalline samples. Electron-microprobe analyses indicated the general composition known for chevkinite-(Ce). Site scattering values determined by single-crystal X-ray structure refinements suggested assignment of subordinate Nb to the octahedral M3 and M4 sites, minor Th to M1 for the Ashizuri sample and minor Mg to M1 for both samples from Pakistan. Neutron time-of-flight powder diffraction studies were applied to determine the Ti/Fe distribution among octahedral sites for all samples and Mossbauer spectroscopy served for the Fe valence assignment at the four octahedral sites. The dominant iron valence at M1 of the Haramosh sample is ferric whereas for samples Nos. 1 and 2 iron is ferrous.

Journal Articles

Crystal and magnetic structures of double hexagonal close-packed iron deuteride

Saito, Hiroyuki*; Machida, Akihiko*; Iizuka, Riko*; Hattori, Takanori; Sano, Asami; Funakoshi, Kenichi*; Sato, Toyoto*; Orimo, Shinichi*; Aoki, Katsutoshi*

Scientific Reports (Internet), 10, p.9934_1 - 9934_8, 2020/06

 Times Cited Count:0 Percentile:100(Multidisciplinary Sciences)

Neutron powder diffraction profiles were collected for iron deuteride (FeDx) while the temperature decreased from 1023 to 300 K for a pressure range of 4-6 GPa. The $$varepsilon$$' deuteride with a double hexagonal close-packed (dhcp) structure, which coexisted with other stable or metastable deutrides at each temperature and pressure condition, formed solid solutions with a composition of FeD$$_{0.68(1)}$$ at 673 K and 6.1 GPa and FeD$$_{0.74(1)}$$ at 603 K and 4.8 GPa. Upon stepwise cooling to 300 K, the D-content x increased to a stoichiometric value of 1.0 to form monodeuteride FeD$$_{1.0}$$. In the dhcp FeD$$_{1.0}$$ at 300 K and 4.2 GPa, dissolved D atoms fully occupied the octahedral interstitial sites, slightly displaced from the octahedral centers in the dhcp metal lattice, and the dhcp sequence of close-packed Fe planes contained hcp-stacking faults at 12%. Magnetic moments with 2.11 $$pm$$ 0.06 B/Fe-atom aligned ferromagnetically in parallel on the Fe planes.

Journal Articles

Water leakage due to the welding defect and improvement to reach 1-MW beam operation in the mercury target of J-PARC

Kogawa, Hiroyuki; Wakui, Takashi; Naoe, Takashi; Haga, Katsuhiro; Takada, Hiroshi; Futakawa, Masatoshi

Journal of Nuclear Science and Technology, 57(5), p.487 - 494, 2020/05

 Times Cited Count:0 Percentile:100(Nuclear Science & Technology)

Neutron flux per pulse reached world record at neutron source in the J-PARC. In the J-PARC, mercury target system is used as a spallation neutron source. A target vessel has the multi-walled protection system that comprises a mercury vessel enclosed with a double-walled water shroud. This is to prevent the leakage of the mercury outside the mercury vessel. The multi-walled structure needed to be complicated with a lot of welding lines. However, during the operation, we faced an unscheduled shutdown due to water leakage to the intermediate layer between the mercury vessel and water shroud. An investigation on the cause of the leakage was carried out. It is deduced that the leakage path was formed due to the crack propagation from welding defects that is caused by the complicated multi-walled structure. The crack propagation is attributed to the repeated stress by pressure waves generated in the mercury target. Based on the investigation results, the design was improved to remove the welding line on the complicated structure and to realize the stable operation with 1 MW proton beam.

Journal Articles

Dynamics of atomic hydrogen in palladium probed by neutron spectroscopy

Kofu, Maiko; Yamamuro, Osamu*

Journal of the Physical Society of Japan, 89(5), p.051002_1 - 051002_12, 2020/05

 Times Cited Count:0 Percentile:100(Physics, Multidisciplinary)

The behavior of hydrogen in metals has attracted much attention in fundamental and applied research areas for many decades. Among metals, palladium is remarkable in that it can absorb large quantities of hydrogen, and hydrogen atoms are highly mobile in the fcc Pd lattice. The dynamics of hydrogen in Pd have been investigated by means of neutron spectroscopy which is the best tool to provide insights into microscopic dynamics of hydrogen atoms. In this article, we review recent and historical neutron scattering works to facilitate the latest understanding of the hydrogen dynamics in bulk and nanometer-sized Pd hydrides.

Journal Articles

Horizontal line nodes in Sr$$_2$$RuO$$_4$$ proved by spin resonance

Iida, Kazuki*; Kofu, Maiko; Suzuki, Katsuhiro*; Murai, Naoki; Kawamura, Seiko; Kajimoto, Ryoichi; Inamura, Yasuhiro; Ishikado, Motoyuki*; Hasegawa, Shunsuke*; Masuda, Takatsugu*; et al.

Journal of the Physical Society of Japan, 89(5), p.053702_1 - 053702_5, 2020/05

 Times Cited Count:1 Percentile:100(Physics, Multidisciplinary)

Journal Articles

Magnetically induced electric polarization in Ba$$_{3}$$Fe$$_{2}$$O$$_{5}$$Cl$$_{2}$$ with tunable direction in three dimensions

Abe, Nobuyuki*; Shiozawa, Shunsuke*; Matsuura, Keisuke*; Sagayama, Hajime*; Nakao, Akiko*; Ohara, Takashi; Tokunaga, Yusuke*; Arima, Takahisa*

Physical Review B, 101(18), p.180407_1 - 180407_5, 2020/05

 Times Cited Count:0 Percentile:100(Materials Science, Multidisciplinary)

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