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The Rashba effect and nontrivial topology related to spintronics are receiving increasing attention. However, there are no clear, effective and universal rules for finding Rashba semiconductors and nontrivial topological insulators (TIs). Herein, through first-principles calculations, we systematically investigate the geometric stability and electronic structures of the MAA'Z$_x$Z'$_{(4-x)}$ systems obtained through comprehensive Janus structural design based on the MA$_2$Z$_4$ (M=Mg, Ga, Sr; A=Al, Ga; Z=S, Se, Te) family. In the process of doping these materials with different Janus configurations, the bandgap decreases continuously with the enhancement of spin-orbit coupling (SOC) strength, and ideal isolated Rashba splitting occurs at the conduction-band minimum (CBM) of multiple materials. It is found that the generation and strength of Rashba splitting are closely related to orbital contribution and charge transfer. Further doping with heavy elements, the material appears to open the bandgap and invert the bands when considering SOC, exhibiting nontrivial TIs features. In addition, the pz orbitals appearing in the valence band after band inversion cause special Rashba splitting at the VBM of multiple materials. Importantly, the Rashba effect, nontrivial topological states, and hybridized spin textures in the MAA'Z$_x$Z'$_{(4-x)}$ systems can be significantly tuned through biaxial strain. Our work not only comprehensively investigates the MAA'Z$_x$Z'$_{(4-x)}$ systems with multifunctional application prospects, but also identifies the mechanisms and principles of Rashba effect and nontrivial topology in Janus materials.

The distribution of nuclear ground-state spin in the two-body random ensemble (TBRE) is studied by using a general classification neural network (NN) model with the two-body interaction matrix elements as input features and corresponding ground-state spins as labels or output predictions. It seems that quantum many-body system problem exceeds the capability of our optimized neural networks when it comes to accurately predicting the ground-state spin of each sample within the TBRE. However, our neural network model effectively captures the statistical properties of the ground-state spin. This may be attributed to the fact that the neural network (NN) model has learned the empirical regularity of the ground-state spin distribution in TBRE, as discovered by human physicists., Comment: 10 pages, 7 figures

Due to the low dimensionality in the quantization of the electronic states and degree of freedom for device modulation, two-dimensional (2D) ferromagnetism plays a critical role in lots of fields. In this study, we perform first-principles calculation to investigate the ising ferromagnetism and half-metallicity of kagome V$_2$O$_3$ monolayer. Based on the calculations using different functional, it is found that GGA-PBE gives a half-metallic band gap while the GGA+U gives a semiconductor narrow band gap (~1.1 meV), which shows quasi-half metallic nature. By studying the magnetic properties with LDA, GGA-PBE, and GGA+U, we get a robust ferromagnetic ground state, where the giant perpendicular magnetic anisotropy energy of ~0.544 meV is achieved by applying the spin-orbit coupling (SOC) with GGA+U. Furthermore, by exploring the orbital contribution to the electronic bands and the magnetic crystalline anisotropy, it is uncovered that the 3d (V) orbitals contribute to the out-of-plane. The electronic band structure shows two flat bands (F1 and F2) and Dirac points (D1 and D2) which further confirm that kagome V$_2$O$_3$ ML can also be used for topological properties. Besides, the Curie temperature of the V$_2$O$_3$ ML is calculated to be 640 K by Metropolis Monte Carlo (MC) simulations.

The abundant bonding possibilities of Carbon stimulate the design of numerous carbon allotropes, promising the foundation for exploring structure-functionality relationships. Herein, utilizing the space bending strategy, we successfully engineered a two-dimensional carbon allotrope with pure sp2 hybridization, named "Wave-graphene" from the unique wave-like ripple structure. The novel Wave-graphene exhibits full-auxetic behavior due to anisotropic mechanical response, possessing both negative and zero Poisson's ratios. The fundamental mechanism can be attributed to the fact that highly buckled out-of-plane structures lead to anisotropic responses of in-plane nonlinear interactions, which further lead to anisotropy of lattice vibrations. In addition, Wave-graphene is found having quasi-direct wide bandgap of 2.01 eV, the excellent optical transparency and the high flexibility. The successful design of Wave-graphene with excellent outstanding multifunctional properties shows that the utilization of space bending strategies can provide more degrees of freedom for designing novel materials, further enriching the carbon material family and supplementing its versatility.

Understanding the fundamental link between structure and functionalization is crucial for the design and optimization of functional materials, since different structural configurations could trigger materials to demonstrate diverse physical, chemical, and electronic properties. However, the correlation between crystal structure and thermal conductivity (\k{appa}) remains enigmatic. In this study, taking two-dimensional (2D) carbon allotropes as study cases, we utilize phonon Boltzmann transport equation (BTE) along with machine learning force constant potential to thoroughly explore the complex folding structure of pure sp2 hybridized carbon materials from the perspective of crystal structure, mode-level phonon resolved thermal transport, and atomic interactions, with the goal of identifying the underlying relationship between 2D geometry and \k{appa}. We propose two potential structure evolution mechanisms for targeted thermal transport properties: in-plane and out-of-plane folding evolutions, which are generally applicable to 2D carbon allotropes. It is revealed that the folded structure produces strong symmetry breaking, and simultaneously produces exceptionally strongly suppressed phonon group velocities, strong phonon-phonon scattering, and weak phonon hydrodynamics, which ultimately lead to low \k{appa}. The insight into the folded effect of atomic structures on thermal transport deepens our understanding of the relationship between structure and functionalization, which offers straightforward guidance for designing novel nanomaterials with targeted \k{appa}, as well as propel developments in materials science and engineering.

The asymmetric properties of Janus two-dimensional materials commonly depend on chemical effects, such as different atoms, elements, material types, etc. Herein, based on carbon gene recombination strategy, we identify an intrinsic non-chemical Janus configuration in a novel purely sp$^2$ hybridized carbon monolayer, named as Janus-graphene. With the carbon gene of tetragonal, hexagonal, and octagonal rings, the spontaneous unilateral growth of carbon atoms drives the non-chemical Janus configuration in Janus-graphene, which is totally different from the chemical effect in common Janus materials such as MoSSe. A structure-independent half-auxetic behavior is mapped in Janus-graphene that the structure maintains expansion whether stretched or compressed, which lies in the key role of $p_z$ orbital. The unprecedented half-auxeticity in Janus-graphene extends intrinsic auxeticity into pure sp$^2$ hybrid carbon configurations. With the unique half-auxeticity emerged in the non-chemical Janus configuration, Janus-graphene enriches the functional carbon family as a promising candidate for micro/nanoelectronic device applications.

The two-dimensional (2D) MA2Z4 family has received extensive attention in manipulating its electronic structure and achieving intriguing physical properties. However, engineering the electronic properties remains a challenge. Herein, based on first-principles calculations, we systematically investigate the effect of biaxial strains on the electronic structures of 2D Rashba MoSiGeN4 (MSGN), and further explore how the interlayer interactions affect the Rashba spin splitting in such strained layered MSGNs. After applying biaxial strains, the band gap decreases monotonically with increasing tensile strains but increases when the compressive strains are applied. An indirect-direct-indirect band gap transition is induced by applying a moderate compressive strain (< 5%) in the MSGNs. Due to the symmetry breaking and moderate spin-orbit coupling (SOC), the monolayer MSGN possess an isolated Rashba spin splitting (R) near the Fermi level, which could be effectively regulated to the Lifshitz transition (L) by biaxial strain. For instance, a L-R-L transformation of Fermi surface is presented in monolayer and a more complex and changeable L-R-L-R evolution is observed in bilayer and trilayer MSGNs as the biaxial strain vary from -8% to 12%, which actually depend on the appearance, variation, and vanish of the Mexican hat band in the absence of SOC under different strains. The contribution of Mo-dz2 orbital hybridized with N-pz orbital in the highest valence band plays a dominant role on the band evolution under biaxial strains, where the R-L evolution corresponds to the decreased Mo-dz2 orbital contribution. Our study highlights the biaxial strain controllable Rashba spin splitting, in particular the introduction and even the evolution of Lifshitz transition near Fermi surface, which makes the strained MSGNs as promising candidates for future applications in spintronic devices., Comment: 21 pages, 7 figures, supplementary information

Graphene+, a novel carbon monolayer with sp2-sp3 hybridization, is recently reported to exhibit graphene-like Dirac properties and unprecedented out-of-plane half-auxetic behavior [Yu et al, Cell Reports Physical Science, 3 100790 (2022)]. Herein, from comprehensively state-of-the-art first-principles studies, we report the exceptional lattice thermal transport properties of graphene+ driven by the unique sp2-sp3 crystal configuration. At room temperature, the thermal conductivity of graphene+ is calculated to be ~170 W/mK, which is much lower than that of graphene (~3170 W/mK) Despite the buckling structure, weak phonon scattering phase space is trapped in graphene+. Thus, the reduction in thermal conductivity magnitude stems from soft bonding due to the unique sp2-sp3 crystal configuration. Soft bonding suppresses the vibrations of acoustic phonons, which leads to strong anharmonicity and weak phonon hydrodynamics. Further, lower group velocity, relaxation time and smaller phonon mean free path emerge in graphene+, and the significantly decreased thermal conductivity is achieved. Our study provides fundamental physical insights into the thermal transport properties of graphene+, and it serves as an ideal model to study atomic bonding versus thermal transport properties due to weak scattering phase space.

Negative Poissons ratio (NPR) is of great interest due to the novel applications in lots of fields. Films are the most commonly used form in practical applications, which involves multiple layers. However, the effect of interlayer interactions on the NPR is still unclear. In this study, based on first principles calculations, we systematically investigate the effect of interlayer interactions on the NPR by comparably studying single-layer graphene, few-layer graphene, h-BN, and graphene-BN heterostructure. It is found that they almost have the same geometry-strain response. Consequently, the NPR in bilayer graphene, triple-layer graphene, and graphene-BN heterostructure are consistent with that in single-layer graphene and h-BN. The fundamental mechanism lies in that the response to strain of the orbital coupling are consistent under the effect of interlayer interactions. The deep understanding of the NPR with the effect of interlayer interactions as achieved in this study is beneficial for the future design and development of micro-/nanoscale electromechanical devices with novel functions based on nanostructures.

The negative Poisson`s ratio (NPR) is a novel property of materials, which enhances the mechanical feature and creates a wide range of application prospects in lots of fields, such as aerospace, electronics, medicine, etc. Fundamental understanding on the mechanism underlying NPR plays an important role in designing advanced mechanical functional materials. However, with different methods used, the origin of NPR is found different and conflicting with each other, for instance, in the representative graphene. In this study, based on machine learning technique, we constructed a moment tensor potential (MTP) for molecular dynamics (MD) simulations of graphene. By analyzing the evolution of key geometries, the increase of bond angle is found to be responsible for the NPR of graphene instead of bond length. The results on the origin of NPR are well consistent with the start-of-art first-principles, which amend the results from MD simulations using classic empirical potentials. Our study facilitates the understanding on the origin of NPR of graphene and paves the way to improve the accuracy of MD simulations being comparable to first-principle calculations. Our study would also promote the applications of machine learning interatomic potentials in multiscale simulations of functional materials. *Author

Auxetic behavior quantified by the negative Poisson's ratio (NPR) is commonly attributed to geometry evolution with re-entrant mechanism or other mechanical factors, which is thought to be independent of electronic structures. Thus, searching for electronic effect dominated auxetic behavior is challenging. Herein, from state-of-the-art first-principles calculations, by studying a class of two-dimensional (2D) transition metal chalcogenides (TMCs), namely X2Y2-type (X=Cu, Ag, Au; Y=O, S, Se) rectangular TMCs (R-TMCs), we identify that the monolayer R-Cu2Se2 unconventionally demonstrates a structure-independent anisotropic NPR. In contrast, the NPR is absent in other R-TMCs. The emerging NPR is attributed to the strong strain response of intralayer interaction in R-Cu2Se2, which can be traced to the lone pair electrons and weak electronegativity of Se atoms under multi-orbital hybridization. The emerging NPR would make R-Cu2Se2 a promising candidate in electronics protection, and our study would provide valuable clues and useful guidance for designing advanced auxetic materials.

Two-dimensional materials have attracted lots of research interests due to the fantastic properties that are unique to the bulk counterparts. In this paper, from the state-of-the-art first-principles, we predicted the stable structure of monolayer counterpart of the {\gamma}-CuI (Cuprous Iodide), which is a p-type wide bandgap semiconductor. The monolayer CuI presents multifunctional superiority in terms of electronic, optical, and thermal transport properties. Specifically, the ultralow thermal conductivity of 0.116 Wm-1K-1 is predicted for monolayer CuI, which is much lower than {\gamma}-CuI (0.997 Wm-1K-1) and other typical semiconductors. Moreover, an ultrawide direct bandgap of 3.57 eV is found in monolayer CuI, which is larger than {\gamma}-CuI (2.95-3.1 eV), promoting the applications in nano-/optoelectronics with better optical performance. The ultralow thermal conductivity and direct wide bandgap of monolayer CuI as reported in this study would promise its potential applications in transparent and wearable electronics., Comment: 16 pages, 4 figures, 37 references

Reducing thermal conductivity ($\kappa$) is an efficient way to boost the thermoelectric performance to achieve direct solid-state conversion to electrical power from thermal energy, which has lots of valuable applications in reusing waste resources. In this study, we propose an effective approach for realizing low $\kappa$ by introducing lone-pair electrons or making the lone-pair electrons stereochemically active through bond nanodesigning. As a case study, by cutting at the (111) cross section of the three-dimensional cubic boron arsenide (c-BAs), the $\kappa$ is lowered by more than one order of magnitude in the resultant two-dimensional system of graphene-like BAs (g-BAs) due to the stereochemically activated lone-pair electrons. Similar concept can be also extended to other systems with lone-pair electrons beyond BAs, such as group III-V compounds, where a strong correlation between $\kappa$ modulation and electronegativity difference for binary compounds is found. Thus, the lone-pair electrons combined with a small electronegativity difference could be the indicator of lowering $\kappa$ through bond nanodesigning to change the coordination environment. The proposed approach for realizing low $\kappa$ and the underlying mechanism uncovered in this study would largely benefit the design of thermoelectric devices with improved performance, especially in future researches involving novel materials for energy applications., Comment: 10 pages, 7 figures, and Supplemental Materials available in the source package. Partially published at http://publications.rwth-aachen.de/record/727017/files/727017.pdf

New classes 2D carbon-based materials beyond graphene have been intensively studied for their promising applications in nano-/opto-/spin-electronics, catalysis, sensors, clean energy, etc. Very recently, the controllable large-scale synthesis of 2D single crystalline carbon nitride (C3N) was reported, which is the first and the only crystalline, hole-free, single-layer carbon nitride with fascinating properties. Herein, we perform a comparative study of thermal transport between monolayer C3N and the parent graphene. The thermal conductivity (k) of C3N shows an anomalous temperature dependence, which is totally different from that for common crystalline materials and deviates largely from the well-known k~1/T relationship. Moreover, the k of C3N is found in surprise to be enlarged by applying bilateral tensile strain, despite its similar planar honeycomb structure as graphene, whose k is reduced upon stretching. The underlying mechanism is revealed by providing direct evidence for the interaction between lone-pair N-s electrons and bonding electrons from C atoms in C3N based on the analysis of orbital-projected electronic structures and electron localization function (ELF). Our study not only make a comprehensive investigation of the thermal transport in graphene-like C3N, but also reveals the physical origins for its anomalous properties, which deepens the understanding of phonon transport in 2D materials., Comment: 10 figures, 12 pages, partially available at http://publications.rwth-aachen.de/record/727017/files/727017.pdf

The Rashba effect, a spin splitting in electronic band structure, attracts much attention for the potential applications in spintronics with no requirement of external magnetic field. Realizing one-dimensional (1D) Rashba system is a big challenge due to the difficulties of growing high-quality heavy-metal nanowires or introducing strong spin-orbit coupling (SOC) and broken inversion symmetry in flexible materials. Here, based on first-principles calculations, we propose a pathway to realize the Rashba spin-split by adsorbing Gd atom on zigzag graphene nanoribbons (Gd-ZGNR) and further investigate the magnetic anisotropy energy (MAE). Perpendicular MAE and unconventional MAE contributions in k-space are found in the self-assembled Gd-ZGNR system, which present a remarkable Rashba effect (the estimated strength is 1.89 eV {\AA}) attributed to strong SOC (~65.6 meV) and the asymmetric adsorption site at the nanoribbons edge. Moreover, first-order MAE is connected to the intrinsic Rashba effect beyond the traditional second-order MAE, which is confirmed based on the analysis of electronic structures perturbed with SOC in comparison with metastable Gd-ZGNR at central symmetric adsorption site. The dependence of first-order MAE as well as Rashba effect of Gd-ZGNRs on the ribbon width are also examined. This work offers new perspective to achieve 1D Rashba system and provides fundamental understanding on the magnetic anisotropy, which would be of great significance for searching Majorana fermions and promoting the potential applications in spintronics., Comment: 27 pages, 6 figures, supplementary information

New classes two-dimensional (2D) materials beyond graphene, including layered and non-layered, and their heterostructures, are currently attracting increasing interest due to their promising applications in nanoelectronics, optoelectronics and clean energy, where thermal transport property is one of the fundamental physical parameters. In this paper, we systematically investigated the phonon transport properties of 2D orthorhombic group IV-VI compounds of $GeS$, $GeSe$, $SnS$ and $SnSe$ by solving the Boltzmann transport equation (BTE) based on first-principles calculations. Despite the similar puckered (hinge-like) structure along the armchair direction as phosphorene, the four monolayer compounds possess diverse anisotropic properties in many aspects, such as phonon group velocity, Young's modulus and lattice thermal conductivity ($\kappa$), etc. Especially, the $\kappa$ along the zigzag and armchair directions of monolayer $GeS$ shows the strongest anisotropy while monolayer $SnS$ and $SnSe$ shows an almost isotropy in phonon transport. The origin of the diverse anisotropy is fully studied and the underlying mechanism is discussed in detail. With limited size, the $\kappa$ could be effectively lowered, and the anisotropy could be effectively modulated by nanostructuring, which would extend the applications in nanoscale thermoelectrics and thermal management. Our study offers fundamental understanding of the anisotropic phonon transport properties of 2D materials, and would be of significance for further study, modulation and aplications in emerging technologies., Comment: 14 pages, 8 figures, 2 tables

We study ten galaxy groups and clusters suggested in the literature to be "fossil system (FS)" based on \chandra\ observations. According to the $M_{500}-T$ and $L_{\rm X}-T$ relations, the gas properties of FSs are not physically distinct from ordinary galaxy groups or clusters. We also first study the $f_{\rm gas,~2500}-T$ relation and find that the FS exhibits same as ordinary systems. The gas densities of FSs within $0.1r_{200}$, are $\sim 10^{-3}$ cm$^{-3}$, which is the same order as galaxy clusters. The entropies within $0.1r_{200}$ ($S_{0.1r_{200}}$) of FSs are systematically lower than those in ordinary galaxy groups which is consistent with previous report, but we find their $S_{0.1r_{200}}-T$ relation is more similar to galaxy clusters. The derived mass profiles of FSs are consistent with the Navarro, Frenk, \& White model in $(0.1-1)r_{200}$, and the relation between scale radius $r_{\rm s}$ and characteristic mass density $ta_{\rm c}$ indicates the self-similarity of dark matter halos of FSs. The range of $r_{\rm s}$ and $ta_{\rm c}$ of FSs are also close to those of galaxy clusters. Therefore, FSs share more common characteristics with galaxy clusters. The special birth place of the FS makes it as a distinct galaxy system type., Comment: 19 pages, 8 figures, accepted by RAA

Phosphorene, the single layer counterpart of black phosphorus, is a novel two-dimensional semiconductor with high carrier mobility and a large fundamental direct band gap, which has attracted tremendous interest recently. Its potential applications in nano-electronics and thermoelectrics call for a fundamental study of the phonon transport. Here, we calculate the intrinsic lattice thermal conductivity of phosphorene by solving the phonon Boltzmann transport equation (BTE) based on first-principles calculations. The thermal conductivity of phosphorene at $300\,\mathrm{K}$ is $30.15\,\mathrm{Wm^{-1}K^{-1}}$ (zigzag) and $13.65\,\mathrm{Wm^{-1}K^{-1}}$ (armchair), showing an obvious anisotropy along different directions. The calculated thermal conductivity fits perfectly to the inverse relation with temperature when the temperature is higher than Debye temperature ($\Theta_D = 278.66\,\mathrm{K}$). In comparison to graphene, the minor contribution around $5\%$ of the ZA mode is responsible for the low thermal conductivity of phosphorene. In addition, the representative mean free path (MFP), a critical size for phonon transport, is also obtained., Comment: 5 pages and 6 figures, Supplemental Material available as http://www.rsc.org/suppdata/cp/c4/c4cp04858j/c4cp04858j1.pdf

A comprehensive first-principles study of the energetics, electronic and magnetic properties of Co-doped GaN(0001) thin films are presented and the effect of surface structure on the magnetic coupling between Co atoms is demonstrated. It is found that Co atoms prefer to substitute the surface Ga sites in different growth conditions. In particular, a CoN/GaN interface structure with Co atoms replacing the first Ga layer is preferred under N-rich and moderately Ga-rich conditions, while CoGax/GaN interface is found to be energetically stable under extremely Ga-rich conditions. It's worth noted that the antiferromagnetic coupling between Co atoms is favorable in clean GaN(0001) surface, but the existence of FM would be expected to occur as Co concentration increased in Ga-bilayer GaN(0001) surface. Our study provides the theoretical understanding for experimental research on Co-doped GaN films and might promise the Co:GaN system potential applications in spin injection devices., Comment: 7 figures

We systematically investigated the geometric, electronic and thermoelectric (TE) properties of bulk black phosphorus (BP) under strain. The hinge-like structure of BP brings unusual mechanical responses such as anisotropic Young's modulus and negative Poisson's ratio. A sensitive electronic structure of BP makes it transform among metal, direct and indirect semiconductors under strain. The maximal figure of merit $ZT$ of BP is found to be 0.72 at $800\,\mathrm{K}$ that could be enhanced to 0.87 by exerting an appropriate strain, revealing BP could be a potential medium-high temperature TE material. Such strain-induced enhancements of TE performance are often observed to occur at the boundary of the direct-indirect band gap transition, which can be attributed to the increase of degeneracy of energy valleys at the transition point. By comparing the structure of BP with SnSe, a family of potential TE materials with hinge-like structure are suggested. This study not only exposes various novel properties of BP under strain, but also proposes effective strategies to seek for better TE materials., Comment: 6 figures. Supplemental Information is available in Scientific Reports and also involved in this source package

In this work, we present a high spatial resolution study of a fossil cluster, SDSS J0150-1005 ($z \simeq 0.364$), based on the imaging spectroscopic analysis of \chandra\ observation. The \chandra\ X-ray image shows a relax and symmetric morphology, which indicates SDSS J0150-1005 is a well-developed galaxy cluster with no sign of recent merger. Its global gas temperature is 5.73 $\pm$ 0.80 keV, and the virial mass is 6.23 $\pm$ 1.34 $\times 10^{14} $ M$_{\odot}$ according to the isothermal model. Compared with polytropic temperature model, the mass calculated based on isothermal model overestimates 49 $\pm$ 11%. The central gas entropy, $S_{0.1r_{200}} = 143.9 \pm 18.3$ keV cm$^2$, is significantly lower than average value of the normal galaxy clusters with similar temperatures. Our results indicate the early formation epoch of SDSS J0150-1005., Comment: 11 pages, 4 figures, accepted by RAA

Based on a 21.5 ks \chandra\ observation of A2556, we identify an edge on the surface brightness profile (SBP) at about 160$h_{71}^{-1}$ kpc northeast of the cluster center, and it corresponds to a shock front whose Mach number $\mathcal{M}$ is calculated to be $1.25_{-0.03}^{+0.02}$. No prominent substructure, such as sub-cluster, is found in either optical or X-ray band that can be associated with the edge, suggesting that the conventional super-sonic motion mechanism may not work in this case. As an alternative solution, we propose that the nonlinear steepening of acoustic wave, which is induced by the turbulence of the ICM at the core of the cluster, can be used to explain the origin of the shock front. Although nonlinear steepening weak shock is expected to occur frequently in clusters, why it is rarely observed still remains a question that requires further investigation, including both deeper X-ray observation and extensive theoretical studies., Comment: 15 pages, 4 figures, accepted by ApJ

Based on a detailed analysis of the high-quality Chandra, XMM-Newton, and Suzaku data of the X-ray bright cluster of galaxies Abell 1795, we report clear evidence for a two-phase intracluster medium (ICM) structure, which consists of a cool (with a temperature T = 2.0-2.2 keV) and a hot (T = 5.0-5.7 keV) component that coexist and dominate the X-ray emission at least in the central 80 kpc. A third weak emission component (T = 0.8 keV) is also detected within the innermost 144 kpc and is ascribed to a portion of inter-stellar medium (ISM) of the cD galaxy. Deprojected spectral analysis reveals flat radial temperature distributions for both the hot phase and cool phase components. These results are consistent with the ASCA measurements reported in Xu et al. (1998), and resemble the previous findings for the Centaurus cluster (e.g., Takahashi et al. 2009). By analyzing the emission measure ratio and gas metal abundance maps created from the Chandra data, we find that the cool phase component is more metal-enriched than the hot phase one in 50-100 kpc region, which agrees with that found in M87 (Simionescu et al. 2008). The coexistence of the cool phase and hot phase ICM cannot be realized by bubble uplifting from active galactic nuclei (AGN) alone. Instead, the two-phase ICM properties are better reconciled with a cD corona model (Makishima et al. 2001). (Abridged), Comment: 47 pages, 12 figures, accepted for publication in ApJ

By analysing the Chandra and XMM-Newton archived data of the nearby galaxy cluster Abell 3158, which was reported to possess a relatively regular, relaxed morphology in the X-ray band in previous works, we identify a bow edge-shaped discontinuity in the X-ray surface brightness distribution at about $120h_{71}^{-1}$ kpc west of the X-ray peak. This feature is found to be associated with a massive, off-centre cool gas clump, and actually forms the west boundary of the cool clump. We find that the cool gas clump is moving at a subsonic velocity of ~700 km/s toward west on the sky plane. We exclude the possibility that this cool clump was formed by local inhomogeneous radiative cooling in the intra-cluster medium, due to the effectiveness of the thermal conduction on the time-scale of $\sim 0.3$ Gyr. Since no evidence for central AGN activity has been found in Abell 3158, and this cool clump bears many similarities to the off-centre cool gas clumps detected in other merging clusters in terms of their mass, size, location, and thermal properties (e.g. lower temperature and higher abundance as compared with the environment), we speculate that the cool clump in Abell 3158 was caused by a merger event, and is the remnant of the original central cool-core of the main cluster or the infalling sub-cluster. This idea is supported not only by the study of line-of-sight velocity distribution of the cluster member galaxies, but also by the study of gas entropy-temperature correlation. This example shows that the appearance of such massive, off-centre cool gas clumps can be used to diagnose the dynamical state of a cluster, especially when prominent shocks and cold fronts are absent., Comment: Accepted by MNRAS; 12 pages, 6 figures

By creating and analyzing the two dimensional gas temperature and abundance maps of the RGH 80 compact galaxy group with the high-quality Chandra data, we detect a high-abundance ($\simeq 0.7$ $Z_\odot$) arc, where the metal abundance is significantly higher than the surrounding regions by $\simeq 0.3$ Z_\odot$. This structure shows tight spatial correlations with the member galaxy PGC 046529, as well as with the arm-like feature identified on the X-ray image in the previous work of Randall et al. (2009). Since no apparent signature of AGN activity is found associated with PGC 046529 in multi-band observations, and the gas temperature, metallicity, and mass of the high-abundance arc resemble those of the ISM of typical early-type galaxies, we conclude that this high-abundance structure is the remnant of the ISM of PGC 046529, which was stripped out of the galaxy by ram pressure stripping due to the motion of PGC 046529 in RGH 80. This novel case shows that ram pressure stripping can work efficiently in the metal enrichment process in galaxy groups, as it can in galaxy clusters., Comment: Accepted by Research in Astronomy and Astrophysics (RAA)