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Molecular Dynamics Simulation of Shock Compression Behavior Based on First-Principles Calculation and Machine-Learning 基于第一性原理计算和机器学习的激波压缩行为分子动力学模拟
Pub Date : 2021-01-01 DOI: 10.4131/jshpreview.31.132
Masaaki Misawa, K. Shimamura, F. Shimojo
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引用次数: 0
Pressure Effects on the Binding of 1,4-Dioxane to Amide Naphthotubes in Water 压力对1,4-二氧六环与酰胺萘管在水中结合的影响
Pub Date : 2021-01-01 DOI: 10.4131/jshpreview.31.90
Shujie Li, R. Kitahara
Host-guest interactions between a pair of naphthalene-based molecular tubes (i.e., anti-isomer and syn-isomer) and 1,4dioxiane have been studied to understand selective recognition. Volume changes for complexation of the amide naphthotubes with 1,4dioxane were investigated using high-pressure fluorescence and high-pressure NMR spectroscopy. We found that the partial molar volume change (DV°) for the association of 1,4dioxane with the naphthotubes was -6.3±0.1 mL mol-1 for the anti-isomer and 3.2±0.4 mL mol-1 for the syn-isomer. To elucidate the molecular basis of DV°, molecular dynamics simulations of the complexation process were also performed. The difference in DV°was attributed to variations in the shape and hydration of naphthotube hydrophobic cavities. [host-guest, supermolecule, fluorescence, NMR, molecular dynamics simulation, cavity, volume change]
研究了一对萘基分子管(即反异构体和同型异构体)与1,4二氧烷之间的主客体相互作用,以了解选择性识别。采用高压荧光和高压核磁共振技术研究了1,4二恶烷与酰胺类萘管络合反应的体积变化。我们发现1,4二氧六环与萘管缔合的偏摩尔体积变化(DV°)为-6.3±0.1 mL mol-1(反异构体)和3.2±0.4 mL mol-1(正异构体)。为了阐明DV°的分子基础,还对络合过程进行了分子动力学模拟。DV°的差异归因于萘管疏水腔的形状和水化作用的变化。[主客,超分子,荧光,核磁共振,分子动力学模拟,空腔,体积变化]
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引用次数: 0
Experimental Study of Crystal Structure and Superconductivity in Hydrides under High Pressure 高压下氢化物晶体结构与超导性的实验研究
Pub Date : 2021-01-01 DOI: 10.4131/jshpreview.31.112
M. Einaga
榮永 茉利 Mari EINAGA The recent collaboration between theory and experiment has led to the discovery of high- T c superconductive hydrogen dominant compounds under ultra-high pressure over one million atmospheres which can be attained by the recent advances in technology using diamond anvil cell. Although there are still various difficulties in measuring the physical properties of materials under ultra-high pressure, high-pressure is expected as an im-portant parameter for development of novel functional materials and search for physical properties, which can-not be realized at ambient pressure. In this article, I review the recent results on the search for pressure-induced superconductivity in sulfur hydride system. [ hydrides, superconductivity, phase transition, synthesis under high temperature and high pressure conditions, DAC, synchrotron powder x-ray diffraction measurement,
最近理论和实验之间的合作导致在超过一百万大气压的超高压下发现了高超导氢主导化合物,这可以通过最近使用金刚石砧细胞的技术进步来实现。虽然在超高压条件下测量材料的物理性质仍然存在各种困难,但高压有望成为开发新型功能材料和寻找物理性质的重要参数,而这在环境压力下是无法实现的。本文综述了近年来在硫化物体系中寻找压力诱导超导性的研究成果。氢化物,超导性,相变,高温高压合成,DAC,同步加速器粉末x射线衍射测量,
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引用次数: 0
Thermodynamics of Shock Vaporization/Devolatilization of Volatile-Bearing Rocks and its Experimental Investigation 含挥发物岩石激波蒸发/脱挥发热力学及实验研究
Pub Date : 2021-01-01 DOI: 10.4131/jshpreview.31.140
K. Kurosawa, G. Komatsu, H. Yabuta, R. Moriwaki, T. Okamoto, H. Sakuma, T. Matsui
1 〒2750016 千葉県習志野市津田沼 2171 千葉工業大学 惑星探査研究センター Planetary Exploration Research Center, Chiba Institute of Technology, 2171 Tsudanuma, Narashino, Chiba 2750016 2 International Research School of Planetary Sciences, Universit à a d'Annunzio, Viale Pindaro, 42, 65127 Pescara, Italy 3 〒7398526 広島県東広島市鏡山 131 広島大学大学院 先進理工学科学研究科 地球惑星システム学プログラム Department of Earth and Planetary Systems Science, Graduate School of Science, Hiroshima University, 131 Kagamiyama, Higashi-Hiroshima, Hiroshima 7398526 4 〒2750016 千葉県習志野市津田沼 2171 千葉工業大学 地球学研究センター Institute for Geo-Cosmorlogy, Chiba Institute of Technology, 2171 Tsudanuma, Narashino, Chiba 2750016 5 〒2525210 神奈川県相模原市中央区由野台 311 宇宙航空研究開発機構 宇宙科学研究所 Institute of Space and Astronautical Science, Japan Aerospace Exploration Agency, 311 Yoshinodai, Chuo-ku, Sagamihara, Kanagawa 2525210 6 〒3050044 茨城県つくば市並木 11 物質・材料研究機構 機能性粘土材料グループ Research Center for Functional Materials, National Institute for Materials Science, 11 Namiki, Tsukuba, Ibaraki 305 0044
1 〒2750016 千葉県習志野市津田沼 2171 千葉工業大学 惑星探査研究センター Planetary Exploration Research Center, Chiba Institute of Technology, 2171 Tsudanuma, Narashino, Chiba 2750016 2 International Research School of Planetary Sciences, Universit à a d'Annunzio, Viale Pindaro, 42, 65127 Pescara, Italy 3 〒7398526 広島県東広島市鏡山 131 広島大学大学院 先進理工学科学研究科 地球惑星システム学プログラム Department of Earth and Planetary Systems Science, Graduate School of Science, Hiroshima University, 131 Kagamiyama, Higashi-Hiroshima, Hiroshima 7398526 4 〒2750016 千葉県習志野市津田沼 2171 千葉工業大学 地球学研究センター Institute for Geo-Cosmorlogy, Chiba Institute of Technology, 2171 Tsudanuma, Narashino, Chiba 2750016 5 〒2525210 神奈川県相模原市中央区由野台 311 宇宙航空研究開発機構 宇宙科学研究所 Institute of Space and Astronautical Science, Japan Aerospace Exploration Agency, 311 Yoshinodai, Chuo-ku, Sagamihara, Kanagawa 2525210 6 〒3050044 茨城県つくば市並木 11 物質・材料研究機構 機能性粘土材料グループ Research Center for Functional Materials, National Institute for Materials Science, 11 Namiki, Tsukuba, Ibaraki 305 0044
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引用次数: 0
Uniaxial-Stress Studies of Multiferroics and Magnetic Skyrmion Systems 多铁质和磁性离子系统的单轴应力研究
Pub Date : 2021-01-01 DOI: 10.4131/jshpreview.31.203
T. Nakajima
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引用次数: 0
Micro-Phase Separation of High Pressure Carbon Dioxide and Water Using Direct Ultra-Sonication for Production of Nano Sized Liposomes 直接超声微相分离高压二氧化碳和水制备纳米脂质体
Pub Date : 2021-01-01 DOI: 10.4131/jshpreview.31.26
Takuso Aida, Hiroki Sakai, Shin-ya Tokunaga, Tanjna Sharmin, K. Mishima
1,2 三島 健司 ,,  Kenji MISHIMA 1,2,  In this article we will discuss our current research conducted for liposome production in high pressure CO 2 -water systems using direct ultra-sonication. Based on our results, we will discuss the advantages of high pressure systems and propose a reaction mechanism focusing
1,2三岛健二1,2,在本文中,我们将讨论我们目前在高压co2 -水系统中使用直接超声波生产脂质体的研究进展。基于我们的研究结果,我们将讨论高压系统的优势,并提出一种聚焦反应机制
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引用次数: 0
Discovery of 20th Ice Polymorphs and Technical Development of High-Pressure Experiment under Electric Field 20号冰晶的发现与电场高压实验技术的发展
Pub Date : 2021-01-01 DOI: 10.4131/jshpreview.31.124
R. Yamane
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引用次数: 0
Ultrafast In-Situ Analysis of Shock-Compressed Planetary Materials 冲击压缩行星材料的超快原位分析
Pub Date : 2021-01-01 DOI: 10.4131/jshpreview.31.166
T. Okuchi, N. Ozaki
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引用次数: 0
Report on Virtual International Conference on High Pressure Bioscience and Biotechnology (HPBB2021) 高压生物科学与生物技术虚拟国际会议报告(HPBB2021)
Pub Date : 2021-01-01 DOI: 10.4131/jshpreview.31.174
T. Shigematsu
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引用次数: 0
Control of Nematic Superconductivity Using Piezo-Device Based Uniaxial-Strain Application Apparatus 利用基于压电器件的单轴应变施加装置控制向列超导
Pub Date : 2021-01-01 DOI: 10.4131/jshpreview.31.236
S. Yonezawa
Shingo YONEZAWA Recent invention of uniaxial-strain application devices using piezo-electric stacks triggered various innovations in condensed-matter physics, providing a unique tool to directly control in situ the crystalline symmetry. In this review, we describe features and usage of piezo-based uniaxial strain devices. We also explain our recent study on the uniaxial-strain study on nematic superconductivity, liquid-crystal-like superconductivity, which was re-cently found in doped Bi 2 Se 3 superconductors. By applying 1  compressive in-plane strain to Sr-doped Bi 2 Se 3 , the configuration of nematic superconducting domains has been successfully controlled. [ uniaxial strain, nematic superconductivity, piezo-based uniaxial-strain application
最近发明的使用压电堆的单轴应变应用装置引发了凝聚态物理的各种创新,提供了一种直接控制原位晶体对称性的独特工具。在这篇综述中,我们描述了压电单轴应变装置的特点和用途。我们还解释了我们最近在掺杂bi2se3超导体中发现的向列超导,液晶类超导的单轴应变研究。通过对掺sr的bi2se3施加1面内压缩应变,成功地控制了向列超导畴的构型。[单轴应变,向列超导,压电基单轴应变应用。
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引用次数: 0
期刊
Review of High Pressure Science and Technology/Koatsuryoku No Kagaku To Gijutsu
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