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A Quasiclassical trajectory calculation to compute the reaction cross section and thermal rate constant for the cesium exchange reaction $$^{133}$$CsI + $$^{135}$$Cs $$rightarrow$$ $$^{133}$$Cs + I$$^{135}$$Cs

小林 孝徳*; 松岡 雷士*; 横山 啓一

Computational and Theoretical Chemistry, 1150, p.40 - 48, 2019/02




酒井 健二; 大井 元貴; 高田 弘; 甲斐 哲也; 中谷 健; 小林 庸男*; 渡邊 聡彦*

JAEA-Technology 2018-011, 57 Pages, 2019/01


核破砕中性子源やミュオン標的などを安全に効率よく運転するために、物質・生命科学実験施設(MLF)は、専用の全体制御システム(GCS)を持ち、運転状況に応じた機器の監視操作やインターロックを運用している。GCSは、その役割に応じて、ネットワーク系(LAN), 統括制御系(ICS), サーバー, インターロック系(ILS), タイミング配信系(TDS)など幾つかのサブシステムで構成される。GCSは、MLF内の機器を独自に運転制御する一方、J-PARCの加速器や他実験施設と連動しながらMLFの安定したビーム運転を実現している。2008年度のビーム運転開始以来、GCSは運転制御コミッショニングに基づく改修を経て、システム性能を継続的に維持する視点から、ICSの大幅なアップグレードやILSの機能拡張を実施してきた(2010年度-2015年度)。この様に運転開始から約10年間、GCSには全般に渡って数多くの追加・変更がなされてきた。従ってGCS高度化の今後の方向性を決めるために、これまでの高度化の履歴とGCSの現況を把握することが重要と考え、2017年度時のGCSの構成・機能・役割を整理して取り纏めた。


Proceedings of the User Group Meeting on MLF Spectrometers (DIRECTION 2018); October 11, 2018, Ibaraki Quantum Beam Research Center (Tokai, Ibaraki, Japan)

梶本 亮一; 横尾 哲也*; 松浦 直人*

JAEA-Review 2018-024, 78 Pages, 2019/01


平成30年10月11日、MLF中性子分光器による合同のユーザーミーティング「DIRECTION 2018」がJ-PARC MLF、高エネルギー加速器研究機構物質構造科学研究所、総合科学研究機構の共催で開催された。本ミーティングは6つの分光器、すなわちBL01(4SEASONS)、BL02(DNA)、BL06(VIN ROSE)、BL12(HRC)、BL14(AMATERAS)、BL23(POLANO)におけるユーザー利用の活性化およびユーザーと装置の協力関係の構築を目指して開催されたものである。研究会では14件の口頭発表および21件のポスター発表が行われ、各装置を利用して行われた研究成果の紹介、各装置や試料環境に関する現状の報告がなされるとともに、装置や試料環境に関する要望や今後の展開等について密接な議論が交わされた。本報告書はこのミーティングの講演要旨および講演で使用された発表資料を収録したものである。


A Telescoping view of solute architectures in a complex fluid system

元川 竜平; 小林 徹; 遠藤 仁; Mu, J.*; Williams, C. D.*; Masters, A. J.*; Antonio, M. R.*; Heller, W. T.*; 長尾 道弘*

ACS Central Science, 5(1), p.85 - 96, 2019/01

We present a hierarchical aggregate model of an organic phase containing a coordination species that acts as a fundamental building unit of higher-order structures formed in the organic phase. We aimed to elucidate the fundamental aspects of the microscopic structure and phase separation occurring in ionic separation and recovery systems during solvent extraction. The coordination species aggregate through a hydrogen-bonding network formed by interaction between the hydrophilic part of the coordination species with extracted water and acid molecules. This reduces the hydrophilic surface area, resulting in subsequent formation of small primal clusters of 2 to 3 nm in diameter. The primal clusters further aggregate due to van der Waals interaction to form large aggregates of $$<$$ 10 nm in diameter. The size of the primal cluster does not depend on the concentration of the coordination species, whereas the size of the large aggregate increases as the aggregation number of the primal clusters increases. We conclude that hybrid interaction is a key driving force in the formation and growth of the hierarchical aggregate and the induction of phase separation of the organic phase.


Invariant incommensurate coherence length in spin-density-wave excitation of Cr$$_{0.99}$$Fe$$_{0.01}$$

平賀 晴弘*; 矢野 真一郎*; 福田 竜生

Journal of Magnetism and Magnetic Materials, 469, p.629 - 632, 2019/01

Low-energy magnetic excitation of spin-density wave (SDW) in a single crystal of Cr$$_{0.99}$$Fe$$_{0.01}$$ was measured using cold neutron triple-axis spectroscopy. Because of the unchanged incommensurability and the constant line width in 2.5 $$leqslanthbaromegaleqslant$$ 6 meV, the magnetic excitation could not be explained with a conventional dispersion of $$hbaromega_qpropto q$$. In this paper, we conjectured the presence of standing waves, which would be excited in local spin matrices. The effectively vertical dispersion was attributed to the longitudinal spin fluctuation in the spin matrices. A series of low-energy magnetic excitations in Cr alloys could be understood with the coexistence of the standing waves and progressive waves such as spin waves.


Unique helical magnetic order and field-induced phase in trillium lattice antiferromagnet EuPtSi

金子 耕士; Frontzek, M. D.*; 松田 雅昌*; 中尾 朗子*; 宗像 孝司*; 大原 高志; 垣花 将司*; 芳賀 芳範; 辺土 正人*; 仲間 隆男*; et al.

Journal of the Physical Society of Japan, 88, p.013702_1 - 013702_5, 2019/01

Magnetic transitions in chiral antiferromagnet EuPtSi were investigated by means of single crystal neutron diffraction. In the ground state, magnetic peaks emerge at positions represented by $$q_{1}$$=$$(0.2, 0.3, 0)$$. Upon heating, an additional magnetic peak splitting around 2.5 K was uncovered, indicating a presence of a first-order transition with $$q^*_{1}$$=$$(0.2, 0.3, {delta})$$. An half-polarized neutron scattering for polarization parallel to Q reveled that polarization antiparallel to Q has stronger intensity in both magnetic phases. This feature clarifies single chiral character of helical structure with moments normal to the ordering vector in both ordered states. Under vertical magnetic field along [1,1,1] in the $$A$$ phase, magnetic peaks form hexagonal patterns in the equatorial scattering plane around nuclear. An ordering vector $$q_{A}$$ of the $$A$$-phase has the similar size in the periodicity to $$q_{1}$$, and could be a hallmark of a formation of skyrmion lattice in EuPtSi.


Manifestation of electron correlation effect in 5$$f$$ states of uranium compounds revealed by 4$$d$$-5$$f$$ resonant photoelectron spectroscopy

藤森 伸一; 小畠 雅明; 竹田 幸治; 岡根 哲夫; 斎藤 祐児; 藤森 淳; 山上 浩志; 芳賀 芳範; 山本 悦嗣; 大貫 惇睦*

Physical Review B, 99(3), p.035109_1 - 035109_5, 2019/01

In the present study, we have elucidated the nature of the electron correlation effect in uranium compounds by imaging the partial $$mathrm{U}~5f$$ density of states (pDOS) of typical itinerant, localized, and heavy fermion uranium compounds by using the $$mathrm{U}$$ 4$$d$$-5$$f$$ resonant photoemission spectroscopy. Obtained $$mathrm{U}~5$$ pDOS exhibit a systematic trend depending on the physical properties of compounds: Although the coherent peak at the Fermi level can be explained by the band-structure calculation, an incoherent peak emerges on the higher binding energy side ($$lesssim 1~mathrm{eV}$$) in the cases of localized and heavy fermion compounds. The intensity and energy position of the incoherent peak is increased and shifted to a higher binding energy as the localization of the $$mathrm{U}~5$$ state increases. These behaviors are consistent with the prediction of the Mott metal-insulator transition, suggesting that the Hubbard-$$U$$ type mechanism takes an essential role in the $$5f$$ electronic structure of actinide materials.


Battery-free, skin-interfaced microfluidic/electronic systems for simultaneous electrochemical, colorimetric, and volumetric analysis of sweat

Bandodkar, A. J.*; Gutruf, P.*; Choi, J.*; Lee, K.-H.*; 関根 由莉奈; Reeder, J. T.*; Jeang, W. J.*; Aranyosi, A. J.*; Lee, S. P.*; Model, J. B.*; et al.

Science Advances (Internet), 5(1), p.eaav3294_1 - eaav3294_15, 2019/01

非侵襲でバイオマーカーを検出し得るウェアラブルデバイスが注目されている。しかしながら現在までに存在するウェアラブルデバイスはその電力源や検出部分などの小型化が困難であったことから重さや大きさの点でポータビリティに欠けていた。本研究では、バッテリーフリーでかつ電気的、呈色式を用いて重要バイオマーカーである塩化物, 乳酸, グルコース, pHを検出できるスウェットデバイスを開発した。



村松 壽晴

スマートプロセス学会誌, 8(1), p.4 - 8, 2019/01



Quasielastic neutron scattering of brucite to analyse hydrogen transport on the atomic scale

奥地 拓生*; 豊岡 尚敬*; Purevjav, N.*; 柴田 薫

Journal of Applied Crystallography, 51, p.1564 - 1570, 2018/12

中性子準弾性散乱(QENS)は、鉱物結晶格子内で起こる原子スケール水素拡散プロセスを分析するための新規かつ有効な方法であることが実証されている。この方法は、凝縮体中の拡散性が高い水素原子または水分子の拡散頻度および距離を分析するために敏感であると以前から考えられていた。本論文では、水酸基として結晶格子に結合している非常に遅い運動の水素原子の拡散運動を分析する応用研究の結果が示されている。ブルーサイト鉱物( brucite)、Mg(OH)$$_{2}$$では、水素原子の単一の二次元層面内でのジャンプとそれに最も近い次の層へのジャンプの2種類の水素拡散プロセスが観察された。ブルーサイトの結晶構造内で観察されるこれらの拡散プロセスは、層状構造を有する様々な種類の酸化物およびミネラル内で起こる水素拡散現象にQENS測定が適用可能であることを示している。


Structure of active sites of Fe-N-C nano-catalysts for alkaline exchange membrane fuel cells

岸 浩史*; 坂本 友和*; 朝澤 浩一郎*; 山口 進*; 加藤 豪士*; Zulevi, B.*; Serov, A.*; Artyushkova, K.*; Atanassov, P.*; 松村 大樹; et al.

Nanomaterials, 8(12), p.965_1 - 965_13, 2018/12

Platinum group metal-free catalysts based on transition metal-nitrogen-carbon nanomaterials have been studied by a combination of in situ X-ray spectroscopy techniques, high-resolution transmission electron microscope, M$"o$ssbauer spectroscopy, electrochemical methods and density functional theory. Fe-N-C oxygen reduction reaction electrocatalysts were synthesized by varying several synthetic parameters to obtain nanomaterials with different composition and morphology. Associated with Fe-N$$_x$$ motive and the presence of Fe metallic particles in the electrocatalysts showed the clear differences in the variation of composition; processing and treatment conditions of sacrificial support method. From the results of material characterization; catalytic activity and theoretical studies; Fe metallic particles (coated with carbon) are main contributors into the HO$$_{2}$$$$^{-}$$ generation.


High-energy magnetic excitations in lightly oxygen-doped lanthanum nickel oxides

中島 健次; 梶本 亮一

Physica B; Condensed Matter, 551, p.142 - 145, 2018/12

We will report on magnetic excitations in lightly oxygen doped lanthanum nickel oxide, La$$_{2}$$NiO$$_{4+delta}$$. By introducing slightly excessive oxygen atoms in the system, magnetic excitations in La$$_{2}$$NiO$$_{4}$$ drastically changes its picture. In lower energy region, spin-wave stiffness strongly suppressed. On the other hand, in the higher energy region, spin-wave dispersion curve is almost same as in the stoichiometric system, while excitations show considerable broadening. Alternation of the character of the excitations by changing energy is also reported in hole doped cuprates and cobalates. We consider that this behavior is one of key clues to understand magnetism and transport properties in carrier doped layered transition metal oxides. We investigated detail of magnetic excitations in two different lightly doped systems, La$$_{2}$$NiO$$_{4.02}$$ and La$$_{2}$$NiO$$_{4.11}$$ in wide momentum and energy transfer space by using time-of-flight spectrometers at J-PARC. Observed doping effects in magnetic excitations will be discussed by comparing them to those reported in other related layered transition metal oxides.


Performances of oscillating radial collimator for the Fermi chopper spectrometer 4SEASONS at J-PARC

中村 充孝; 神原 理*; 飯田 一樹*; 梶本 亮一; 蒲沢 和也*; 池内 和彦*; 石角 元志*; 青山 和弘*

Physica B; Condensed Matter, 551, p.480 - 483, 2018/12



Phonon dynamics of NaI investigated by G($$r,E$$) analysis

中村 充孝; 菊地 龍弥*; 蒲沢 和也*; 川北 至信

Physica B; Condensed Matter, 551, p.351 - 354, 2018/12



Characteristics of the 2012 model lithium-6 time-analyzer neutron detector (LiTA12) system as a high efficiency detector for resonance absorption imaging

甲斐 哲也; 佐藤 節夫*; 廣井 孝介; Su, Y.; 瀬川 麻里子; Parker, J. D.*; 松本 吉弘*; 林田 洋寿*; 篠原 武尚; 及川 健一; et al.

Physica B; Condensed Matter, 551, p.496 - 500, 2018/12

The 2012 model lithium-6 time-analyzer neutron detector (LiTA12) system, based on a lithium glass scintillator and multi-anode photomultiplier tube, has the highest neutron efficiency among the detectors for pulsed neutron imaging together with a flexibility of the efficiency by changing the thickness of the lithium glass. The authors expect this detector system could become a main detector system for the energy-resolved neutron imaging system, RADEN, at J-PARC, and have started evaluation of the LiTA12 system. For example, spatial resolution for resonance absorption imaging was evaluated by using a line-pair pattern made by 3 micro meter thick gold on a quartz plate. Less than 1 mm width line pairs were resolved at an 8 Mcps neutron counting rate and around 5 eV neutron energy.


Local structure study of the iron-based systems of BaFe$$_2$$As$$_2$$ and LiFeAs by X-ray PDF and XAFS analyses

Li, S.*; 豊田 真幸*; 小林 義明*; 伊藤 正行*; 池内 和彦*; 米田 安宏; 大谷 彬*; 松村 大樹; 浅野 駿*; 水木 純一郎*; et al.

Physica C, 555, p.45 - 53, 2018/12



Evaluation of residual stress relaxation in a rolled joint by neutron diffraction

林 眞琴*; Root, J. H.*; Rogge, R. B.*; 徐 平光

Quantum Beam Science (Internet), 2(4), p.21_1 - 21_16, 2018/12

The rolled joint of pressure tube, consisting of three axial symmetric parts, modified SUS403 stainless steel, Zr-2.5Nb pressure tube and Inconel-718, has been examined by neutron diffraction for residual stresses. It was heat treated at 350$$^{circ}$$C for 30, 130 and 635 hours to simulate the thermal aging of the rolled joint over the lifetime of the advanced thermal reactor at 288$$^{circ}$$C for 1, 5 and 30 years. The crystal lattice strains at various locations in the rolled joint before and after the aging treatments were measured by neutron diffraction and the residual stress distribution in the rolled joint was evaluated by using the Kroner elastic model and the generalized Hooke's law. In the crimp region of the rolled joint, it was found that the aging treatment had weak effect on the residual stresses in the Inconel and the SUS403. In the non-aged Zr-2.5Nb, the highest residual stresses were found near its interface with the SUS430. In the Zr-2.5Nb in the crimp region near its interface with the SUS430, the average compressive axial stress was -440 MPa, having no evident change during the long-time aging. In the Zr-2.5Nb outside closest to the crimp region, the tensile axial and hoop stresses were relieved during the 30 hours aging. The hoop stresses in the crimp region evolved from an average tensile stress of 80 MPa to an average compressive stress of 230 MPa after the 635 hours aging, suggesting that the rolled joint had a good long-term sealing ability against the leakage of high temperature water.


X-ray absorption study of platinum nanoparticles on an ion-irradiated carbon support

垣谷 健太*; 木全 哲也*; 八巻 徹也*; 山本 春也*; 松村 大樹; 田口 富嗣*; 寺井 隆幸*

Radiation Physics and Chemistry, 153, p.152 - 155, 2018/12

The chemical state and local structure of 2.6-nm-sized platinum (Pt) nanoparticles on an ion-irradiated glassy carbon (GC) substrate were investigated by X-ray absorption fine structure measurements. The partial oxidation of the Pt nanoparticles was confirmed by the peak intensity in the near-edge region of the absorption spectrum. The analysis of the extended region revealed a higher coordination number and shorter bond length of Pt-Pt compared to those of the Pt nanoparticles on the non-ion-irradiated GC. Thus, Pt nanoparticles on the ionirradiated GC substrate were found to hold a rigid metallic coordination during the oxidation.



関根 由莉奈

四季, 41, P. 4, 2018/12



Local disorder in proton conductor BaSn$$_{0.5}$$In$$_{0.5}$$O$$_{2.75}$$ analyzed by neutron diffraction/ atomic pair distribution function

井川 直樹; 樹神 克明; 田口 富嗣*; 吉田 幸彦*; 松川 健*; 星川 晃範*; 石垣 徹*

Transactions of the Materials Research Society of Japan, 43(6), p.329 - 332, 2018/12

プロトン伝導体BaSn$$_{0.5}$$In$$_{0.5}$$O$$_{2.75}$$の電気的特性に及ぼす結晶構造の影響を理解するため、本材料における局所構造乱れを中性子回折/原子対分布関数(PDF)法を用いて解析した。本材料の局所構造は、${it r}$ $$>$$ 0.6nmの原子間距離範囲内では、リートベルト解析によって推定された平均構造と同様の立方晶構造(空間群$${it Pm}$$$$overline{3}$$$${it m}$$))である。一方、${it r}$ $$<$$ 0.6nmの範囲のPDFプロファイルは、立方晶構造よりも空間群${it P}$4/${it mmm}$の正方晶構造によって良い一致をみた。これらの結果は、格子内の局所構造乱れの存在を示している。本発表では、BaSn$$_{0.5}$$In$$_{0.5}$$O$$_{2.75}$$の平均構造と局所構造との関係の詳細について考察する。

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