arXiv subjects

Ling Tang

Publications and source records attributed to Ling Tang.

29 records · Page 2Linked to original sources

arXiv2022

Sketch-and-project methods for tensor linear systems

For tensor linear systems with respect to the popular t-product, we first present the sketch-and-project method and its adaptive variants. Their Fourier domain versions are also investigated. Then, considering that the existing sketching tensor or way for sampling has some limitations, we propose two improved strategies. Convergence analyses for the methods mentioned above are provided. We compare our methods with the existing ones using synthetic and real data. Numerical results show that they have quite decent performance in terms of the number of iterations and running time.

math.NA↗

arXiv2020

Novel structural evolution of several nanolaminate Mn+1AXn (n=1, 2, 3, etc.) ceramics under pressure from first principles

We did extensive research for the typical nanolaminate Mn+1AXn (n=1, 2, 3) ceramics focusing on the structural stability, the phase transition pressure of Ti2GaN (160 GPa) is far higher than that of Zr2GaN (92 GPa), meaning the strong M dependence of the same group, whereas Zr2AlN (98 GPa) has similar value with that of Zr2GaN, meaning the weak A dependence. Mo2GaC shows lowest phase transition pressure among all of the known MAX, meaning that C-containing phase has lower phase transition pressure than that of N-containing counterparts. All of the metastable phases of the selected MAX transition almost at the same time, such as all of the metastable phases of Zr2AlN transition at the similar pressure, about 90-110 GPa, with a very narrow pressure range of less than 20 GPa, as is also the case for Zr2GaN corresponding to 90-115 GPa and for Mo2GaC corresponding to 10-25 GPa. Mo2GaC presents multi-phase co-existence status at high pressure, whose P63/mmc alpha-beta phase transition is the more commonly and frequently occurred route in this kind of MAX structure. The hexagonal P63-mmc to tetragonal P4-mmm transition is the common direct route for the N-containing MAX due probably to the high transition pressure. P63/mmc alpha-beta-P4-mmm transition might be the common route for the C-containing MAX due probably to the low alpha-beta transition pressure. Nb2InN(Nb2GaN) and Mo2InN present c-axis abnormal elongation at low pressures, these compounds have negative formation of energy at ambient conditions, meaning that all of them are stable or experimentally synthesizeable.

cond-mat.mtrl-sci↗

arXiv2018

Structures and magnetic properties of iron silicide from adaptive genetic algorithm and first-principles calculations

We performed a systematic search for low-energy structures of binary iron silicide over a wide range of compositions using the crystal structure prediction method based on adaptive genetic algorithm. 36 structures with formation energies within 50 meV/atom (11 of them are within 20 meV) above the convex hull formed by experimentally known stable structures are predicted. Magnetic properties of these low-energy structures are investigated. Some of these structures can be promising candidates for rare-earth-free permanent magnet.

cond-mat.mes-hall↗

arXiv2018

Structural and Chemical Orders in Ni64.5Zr35.5 Metallic Glass by Molecular Dynamics Simulation

The atomic structure of Ni64.5Zr35.5 metallic glass has been investigated by molecular dynamics (MD) simulations. The calculated structure factors from the MD glassy sample at room temperature agree well with the X-ray diffraction (XRD) and neutron diffraction (ND) experimental data. Using the pairwise cluster alignment and clique analysis methods, we show that there are three types dominant short-range order (SRO) motifs around Ni atoms in the glass sample of Ni64.5Zr35.5, i.e., Mixed-Icosahedron(ICO)-Cube, Twined-Cube and icosahedron-like clusters. Furthermore, chemical order and medium-range order (MRO) analysis show that the Mixed-ICO-Cube and Twined-Cube clusters exhibit the characteristics of the crystalline B2 phase. Our simulation results suggest that the weak glass-forming ability (GFA) of Ni64.5Zr35.5 can be attributed to the competition between the glass forming ICO SRO and the crystalline Mixed-ICO-Cube and Twined-Cube motifs.

cond-mat.mes-hall↗

arXiv2016

Evidence of the stability of Mo_{2}TiAlC_{2} from first principles calculations and its thermodynamical and optical properties

The elastic, thermodynamic, and optical properties of Mo_{2}TiAlC_{2} are investigated by first-principles calculations. Our results indicate that the a axis is stiffer than c axis within 0~100 GPa. Elastic constants calculations predict the large stability range of Mo_{2}TiAlC_{2} under pressure. Several important thermodynamic properties are discussed detailedly, including the Debye temperature, thermal expansion coefficient, and heat capacity etc. The bonding properties are studied from the elastic quantities and electronic properties. The electronic properties are investigated, including the energy band structure, density of states, and so on. The evidence of the instability of Mo_{3}AlC_{2} and stability of Mo_{2}TiAlC_{2} are successfully obtained.

cond-mat.mes-hall↗

arXiv2016

Asymmetric angular dependence of spin-transfer torques in CoFe/Mg-B-O/CoFe magnetic tunnel junctions

Using a first-principles noncollinear wave-function-matching method, we studied the spin-transfer torques (STTs) in CoFe/Mg-B-O/CoFe(001) magnetic tunnel junctions (MTJs), where three different types of B-doped MgO in the spacer are considered, including B atoms replacing Mg atoms (Mg$_3$BO$_4$), B atoms replacing O atoms (Mg$_4$BO$_3$), and B atoms occupying interstitial positions (Mg$_4$BO$_4$) in MgO. A strong asymmetric angular dependence of STT can be obtained both in ballistic CoFe/Mg$_3$BO$_4$ and CoFe/Mg$_4$BO$_4$ based MTJs, whereas a nearly symmetric STT curve is observed in the junctions based on CoFe/Mg$_4$BO$_3$. Furthermore, the asymmetry of the angular dependence of STT can be suppressed significantly by the disorder of B distribution. Such skewness of STTs in the CoFe/Mg-B-O/CoFe MTJs could be attributed to the interfacial resonance states induced by the B diffusion into MgO spacer. The present investigation demonstrates the feasibility of effectively enhancing microwave output power in MgO based spin torque oscillator (STO) by doping the B atoms into MgO spacer.

cond-mat.mes-hall↗

arXiv2013

First-principles study of spin-transfer torque in Co2MnSi/Al/Co2MnSi spin-valve

The spin-transfer torque (STT) in Co2MnSi(CMS)/Al/Co2MnSi spin-valve system with and without interfacial disorder is studied by a first-principles noncollinear wave-function-matching method. It is shown that in the case of clean interface the angular dependence of STT for CoCo/Al (the asymmetry parameter Lambda approx. 4.5) is more skewed than that for MnSi/Al (Lambda approx. 2.9), which suggests the clean CoCo/Al architecture is much more efficient for the application on radio frequency oscillation. We also find that even with interfacial disorder the spin-valve of half-metallic CMS still has a relatively large parameter Lambda compared to that of conventional ferromagnet. In addition, for clean interface the in-plane torkance of MnSi/Al is about twice as large as that of CoCo/Al. However, as long as the degree of interfacial disorder is sufficiently large, the CoCo/Al and MnSi/Al will show approximately the same magnitude of in-plane torkance. Furthermore, our results demonstrate that CMS/Al/CMS system has very high efficiency of STT to switch the magnetic layer of spin-valve.

cond-mat.mes-hall↗

arXiv2013

The numerical operator method to the real time dynamics of currents through the nanostructures with different topologies

We present the numerical operator method designed for the real time dynamics of currents through nanostructures beyond the linear response regime. We apply this method to the transient and stationary currents through nanostructures with different topologies, e.g., the flakes of square and honeycomb lattices. We find a quasi-stationary stage with a life proportional to the flake size in the transient currents through the square flakes, but this quasi-stationary stage is destroyed in the presence of disorder. However, there is no quasi-stationary stage in the transient currents through the honeycomb flakes, showing that the transient current depends strongly upon the topologies of the nanostructures. We also study the stationary current by taking the limit of the current at long times. We find that the stationary current through a square flake increases smoothly as the voltage bias increasing. In contrast, we find a threshold voltage in the current-voltage curve through a honeycomb flake, indicating a gap at the Fermi energy of a honeycomb flake.

cond-mat.mes-hall↗

arXiv2013

First-principles calculations of current-induced spin-transfer torques in magnetic domain walls

Current-induced spin-transfer torques (STTs) have been studied in Fe, Co and Ni domain walls (DWs) by the method based on the first-principles noncollinear calculations of scattering wave functions expanded in the tight-binding linearized muffin-tin orbital (TB-LMTO) basis. The results show that the out-of-plane component of nonadiabatic STT in Fe DW has localized form, which is in contrast to the typical nonlocal oscillating nonadiabatic torques obtained in Co and Ni DWs. Meanwhile, the degree of nonadiabaticity in STT is also much greater for Fe DW. Further, our results demonstrate that compared to the well-known first-order nonadiabatic STT, the torque in the third-order spatial derivative of local spin can better describe the distribution of localized nonadiabatic STT in Fe DW. The dynamics of local spin driven by this third-order torques in Fe DW have been investigated by the Landau-Lifshitz-Gilbert (LLG) equation. The calculated results show that with the same amplitude of STTs the DW velocity induced by this third-order term is about half of the wall speed for the case of the first-order nonadiabatic STT.

cond-mat.mes-hall↗

arXiv2013

First-principles calculations of spin-triplet andreev reflection spectra at half-metallic ferromagnet/superconductor interface

Combining the first-principles noncollinear calculations of scattering matrices with Andreev approximation, we investigated the spin-triplet Andreev reflection (AR) spectra for the interface between half-metallic ferromagnet Co$_{2}$MnSi and \emph{s}-wave BCS superconductor Al with and without interfacial roughness, where the orientations of magnetic moments near the interface are randomly distributed. The calculated results show that the AR spectra have peak structures near zero bias for the clean interface with relative weak magnetic disorder. With increasing the degree of interfacial roughness or magnetic disorder, these subgap peaks of conductance spectra will be washed out. The results also show that the value of subgap conductance spectrum can be raised significantly by the magnetic disorder. Finally, our calculations reveal that the long-range spin-triplet AR in Co$_{2}$MnSi/Al(001) interface can be enhanced by a small amount of interfacial roughness.

cond-mat.mes-hall↗

arXiv2008

First Principle Noncollinear Transport Calculation and Interfacial Spin-flipping of Cu/Co Multilayers

In this paper the first principle noncollinear transport calculation for Cu/Co(111) including interfacial spin-flipping was performed. We modeled spin-flipping at the interface by assuming a noncollinear magnetic structure with random magnetization orientation which satisfied Gaussian distribution along average magnetization direction. The relationship between spin-dependent conductance including interfacial spin-flipping and random magnetization orientation distribution width was obtained. For certain distribution width, our defined spin-flipping ratio coincides with the range of experimental spin-flipping probability $P=1-e^{-δ}$, where $δ=0.25\pm0.1$. The magnetoresistance in Co/Cu/Co spin valve system including interfacial spin-flipping has also been calculated.

cond-mat.mes-hall↗