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Unconventional phonon spectra and obstructed edge phonon modes

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Science China(physics,Mechanics & Astronomy) 2024年第4期67卷 114-118页

作者： Ruihan Zhang Haohao Sheng Junze Deng Zhong Fang Zhilong Yang Zhijun Wang beijing national laboratory for condensed matter physics and Institute of PhysicsChinese Academy of SciencesBeijing 100190China University of Chinese Academy of Sciences Beijing 100049China

Based on the elementary band representations(EBR),many topologically trivial materials are classified as unconventional ones(obstructed atomic limit),where the EBR decomposition for a set of electronic states is not consistent with atomic valenceelectron band *** the work,we identify that the unconventional nature can also exist in phonon spectra,where the EBR decomposition for a set of well-separated phonon modes is not consistent with atomic vibration band representations(ABR).The unconventionality has two types:typeⅠis on an empty site;and typeⅡis on an atom site with non-atomic vibration *** unconventionality is described by the nonzero real-space invariant at the *** detailed calculations show that the black phosphorus(BP)has the typeⅠunconventional phonon spectrum,while 1H-Mo Se_(2)has the typeⅡone,although their electronic structures are also ***,the obstructed phonon modes are obtained for two types of unconventional phonon spectra.

关键词： unconventional phonon spectra obstructed edge phonon mode typeⅠ&typeⅡunconventionality

Observation of parabolic electron bands on superconductor LaRu2As2

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Chinese physics B 2024年第7期33卷 70-75页

作者：周兴泰李更潘禄禄陈子超李萌时延昊杨海涛高鸿钧 beijing national Center for condensed matter physics and institute of physics Chinese Academy of Sciences School of Physical Sciences University of Chinese Academy of Sciences Hefei national laboratory

Ru-based superconductor LaRu2As2has been discovered exhibiting the highest critical temperature of ～ 7.8 K among iron-free transition metal pnictides with the ThCr2Si2-type crystal structure. However, microscopic research on this novel superconducting material is still lacking. Here, we utilize scanning tunneling microscopy/spectroscopy to uncover the superconductivity and surface structure of LaRu2As2. Two distinct terminating surfaces are identified on the cleaved crystals, namely, the As surface and the La surface. Atomic missing line defects are observed on the La surface. Both surfaces exhibit a superconducting gap of ～ 1.0 me V. By employing quasiparticle interference techniques, we observe standing wave patterns near the line defects on the La atomic plane. These patterns are attributed to quasiparticle scattering from two electron type parabolic bands.

关键词： superconductivity line defect quasi-particle scattering electron band

Effect of trace oxygen on plasma nitriding of titanium foil

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Chinese physics B 2024年第6期33卷 548-551页

作者：周海涛熊希雅马可欣罗炳威罗飞申承民 beijing institute of Aeronautical Materials Aero Engine Corporation of ChinaBeijing 100095China beijing national laboratory of condensed matter physics Institute of PhysicsChinese Academy of SciencesBeijing 100190China

Titanium nitride films are prepared by plasma enhanced chemical vapor deposition method on titanium foil using N_(2) as precursor. In order to evaluate the effect of oxygen on the growth of titanium nitride films, a small amount of O_(2) is introduced into the preparation process. The study indicates that trace O_(2) addition into the reaction chamber gives rise to significant changes on the color and micro-morphology of the foil, featuring dense and long nano-wires. The as-synthesized nanostructures are characterized by various methods and identified as TiN, Ti_(2) N, and TiO_(2) respectively. Moreover, the experiment results show that oxide nanowire has a high degree of crystallinity and the nitrides present specific orientation relationships with the titanium matrix.

关键词： nitride oxide nanostructure crystalline plasma-enhanced chemical vapor deposition system(PECVD)

Preparing highly entangled states of nanodiamond rotation and NV center spin

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Chinese physics B 2024年第2期33卷 144-151页

作者：李文亮周端陆 institute of physics Beijing National Laboratory for Condensed Matter PhysicsChinese Academy of SciencesBeijing 100190China School of Physical Sciences University of Chinese Academy of SciencesBeijing 100049China

A nanodiamond with an embedded nitrogen-vacancy(NV)center is one of the experimental systems that can be coherently manipulated within current *** between NV center electron spin and mechanical rotation of the nanodiamond plays a fundamental role in building a quantum network connecting these microscopic and mesoscopic degrees of *** we present a protocol to asymptotically prepare a highly entangled state of the total quantum angular momentum and electron spin by adiabatically boosting the external magnetic field.

关键词： nanodiamond NV center entanglement

Quantum synchronization with correlated baths

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Chinese physics B 2024年第2期33卷 152-157页

作者：李磊王春辉尹洪浩王如泉刘伍明 School of Physical Science and Technology Inner Mongolia UniversityHohhot 010021China beijing national laboratory for condensed matter physics Institute of PhysicsChinese Academy of SciencesBeijing 100190China

We study quantum synchronization under the nonequilibrium *** consider a two-qubit XXZ chain coupled independently to their own reservoirs modeled by the collisional *** reservoir particles,initially prepared in a thermal state or a state with coherence,are correlated through a unitary transformation and afterward interact locally with the two quantum *** study the quantum effect of reservoir on synchronous dynamics of *** preparing different reservoir initial states or manipulating the reservoir particles coupling and the temperature gradient,we find that quantum entanglement of reservoir is the key to control quantum synchronization of system qubits.

关键词： quantum synchronization entanglement quantum coherence nonequilibrium reservoir

Monophase-homointerface electrodes intrinsically stabilize high-voltage all-solid-state batteries

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Science China Chemistry 2024年第5期67卷 1729-1739页

作者： Xiaolin Xiong Xianguo Ma Tianshi Lv Liquan Chen Liumin Suo beijing national laboratory for condensed matter physics Institute of PhysicsChinese Academy of ScienceBeijing 100190China Center of Materials Science and Optoelectronics Engineering University of Chinese Academy of SciencesBeijing 100049China

The electrochemical stability and contact reliability of heterointerfaces between the solid electrolyte(SE) and electrode are critical for all-solid-state batteries(ASSBs), particularly much more challenging for high-voltage ASSBs, owing to the limited thermodynamically electrochemical window and mechanical inflexibility of SE, aggravating interfacial side reactions and contact failure. Considering all those issues originating from intrinsic heterogeneity in physicochemical features between the cathode material and SE, we are thinking about simplifying the heterointerfaces into a homointerface as a permanent cure to solve all electrochemical-mechanical interfacial failure. Herein, we propose monophase cathodes to construct thermodynamically stable all-in-one homointerfaces in ASS electrodes, removing unstable heterointerfaces by excluding SEs and intrinsically eliminating the Li chemical potential gap to avoid the formation of lithium-depleted space-charge layer and highly resistive mixed ion–electron conductor interphase. Our conception is successfully validated in the layered transition-metal oxide cathodes, which display outstanding stability no matter the MH-LiCoO_(2) cathode charging to 4.7 V or MH-Li_(1.2)Mn_(0.54)Ni_(0.13)-Co_(0.13)O_(2) cathode charging to 5.3 V. It is undeniable that our current version of above-illustrated MH-cathodes would bring out some new challenges for the practical application due to abandoning the SE. However, we believe our work also offers a brandnew direction to ultimately address the electrochemical–mechanical interfacial issues that would be promising for high-energy ASSBs with more discoveries of advanced monophase cathodes in the future.

关键词： monophase-homointerface electrode high-voltage all-solid-state batteries electrochemical-mechanical interfacial issue

Tailoring-compensated ferrimagnetic state and anomalous Hall effect in quaternary Mn–Ru–V–Ga Heusler compounds

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Chinese physics B 2024年第7期33卷 595-603页

作者：梁瑾静郗学奎王文洪刘永昌 beijing national laboratory for condensed matter physics Institute of PhysicsChinese Academy of SciencesBeijing 100190China University of Chinese Academy of Sciences Beijing 100049China Tiangong University Tianjin 300387China

Cubic Mn_(2)Ru_(x)Ga Heusler compound is a typical example of compensated ferrimagnet with attractive potential for high-density,ultrafast,and low-power spintronic *** the form of epitaxial thin films,Mn_(2)Ru_(x)Ga exhibits high spin polarization and high tunability of compensation temperature by freely changing the Ru content x in a broad range(0.3

关键词： compensated ferrimagnet anomalous Hall effect residual resistivity ratio

C-Type Antiferromagnetic Structure of Topological Semimetal CaMnSb2

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Chinese physics Letters 2024年第03期41卷 119-125页

作者：李博曾旭涛徐千惠杨帆项俊森钟恒扬邓司浩何伦华徐菊萍殷雯鲁兴业刘慧颖胜献雷金文涛 School of physics Beihang University beijing national laboratory for condensed matter physics and Institute of PhysicsChinese Academy of Sciences Center for Advanced Quantum Studies and Department of physics Beijing Normal University Spallation Neutron Source Science Center Songshan Lake Materials laboratory

Determination of the magnetic structure and confirmation of the presence or absence of inversion （P） and time reversal （Τ） symmetry is imperative for correctly understanding the topological magnetic materials. He... 详细信息

关键词： Density functional theory

Databases of 2D material-substrate interfaces and 2D charged building blocks

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Chinese physics B 2024年第2期33卷 34-38页

作者：邓俊潘金波杜世萱 beijing national laboratory for condensed matter physics Institute of PhysicsChinese Academy of SciencesBeijing 100190China School of physics University of Chinese Academy of SciencesBeijing 100049China Songshan Lake Materials laboratory Dongguan 523808China

Discovery of materials using“bottom-up”or“top-down”approach is of great interest in materials *** materials consisting of two-dimensional(2D)building blocks provide a good platform to explore new materials in this *** van der Waals(vdW)layered materials,these building blocks are charge neutral and can be isolated from their bulk phase(top-down),but usually grow on *** ionic layered materials,they are charged and usually cannot exist independently but can serve as motifs to construct new materials(bottom-up).In this paper,we introduce our recently constructed databases for 2D material-substrate interface(2DMSI),and 2D charged building *** 2DMSI database,we systematically build a workflow to predict appropriate substrates and their geometries at substrates,and construct the 2DMSI *** the 2D charged building block database,1208 entries from bulk material database are *** of crystal structure,valence state,source,dimension and so on is provided for each entry with a json *** also show its application in designing and searching for new functional layered *** 2DMSI database,building block database,and designed layered materials are available in Science Data Bank at https://***/10.57760/sciencedb.j00113.00188.

关键词： 2D material-substrate interfaces charged building block database functional-oriented materials design layered materials density functional theory