The realization of 100%polarized topologicalWeyl fermions in half-metallic ferromagnets is of particular importance for fundamental research and spintronic applications.Here,we theoretically investigate the electronic...The realization of 100%polarized topologicalWeyl fermions in half-metallic ferromagnets is of particular importance for fundamental research and spintronic applications.Here,we theoretically investigate the electronic and topological properties of the zinc-blende compound VAs,which was deemed as a half-metallic ferromagnet related to dynamic correlations.Based on the combination of density functional theory and dynamical mean field theory,we uncover that the half-metallic ferromagnet VAs exhibits attractive Weyl semimetallic behaviors which are very close to the Fermi level in the DFT+U regime with effect U values ranging from 1.5 eV to 2.5 eV.Meanwhile,we also investigate the magnetization-dependent topological properties;the results show that the change of magnetization directions only slightly affects the positions of Weyl points,which is attributed to the weak spin–orbital coupling effects.The topological surface states of VAs projected on semi-infinite(001)and(111)surfaces are investigated.The Fermi arcs of all Weyl points are clearly visible on the projected Fermi surfaces.Our findings suggest that VAs is a fully spin-polarized Weyl semimetal with many-body correlated effects in the effective U values range from 1.5 eV to 2.5 eV.展开更多
Half-Heusler(HH)合金由于其本身具有较为优异的力学性能和高温热稳定性,已成为目前最具有应用前景的中高温热电材料之一。然而,其本身较高的本征晶格热导率阻碍了热电性能的进一步提升。本文以P型Zr Co Sb0.85Sn0.15合金为研究对象,基...Half-Heusler(HH)合金由于其本身具有较为优异的力学性能和高温热稳定性,已成为目前最具有应用前景的中高温热电材料之一。然而,其本身较高的本征晶格热导率阻碍了热电性能的进一步提升。本文以P型Zr Co Sb0.85Sn0.15合金为研究对象,基于同构合金化具有优异P型热电性能的(Nb0.8Ta0.2)0.8Ti0.2Fe Sb,通过磁悬浮熔炼和放电等离子烧结设计并制备出一种(Zr Co Sb0.85Sn0.15)1-x[(Nb0.8Ta0.2)0.8Ti0.2Fe Sb]x(x=0,0.2,0.3,0.4,0.5)高熵HH合金。微观组织分析表明,同构合金化这一策略引入了大量多尺度多衬度的第二相,这将有效增强对声子的散射。其中,当同构合金化含量为0.3时,晶格热导率在923 K时从Zr Co Sb0.85Sn0.15的4.72 W·m-1·K-1降至3.07 W·m-1·K-1,降低了35%。然而,由于多位点合金化元素间存在较为复杂的掺杂效果,使其电导率和塞贝克系数同时降低,最终导致热电优值存在一定的降低。本研究工作表明,高熵合金设计思想是一种降低HH热电合金晶格热导率的有力措施。展开更多
P-sets is a set pair, it is composed of internal P-set and outer P-set, it has dynamic characteristic. By using structure of P-sets, dependence theorem and identification theorem are proposed in this paper.
Function P-sets are a set pair which are composed of function internal packetsets S F and function outer packet sets S F or (S F , S F ) are function P-sets. Function P-sets have dynamic characteristics and law charac...Function P-sets are a set pair which are composed of function internal packetsets S F and function outer packet sets S F or (S F , S F ) are function P-sets. Function P-sets have dynamic characteristics and law characteristics. Based on function P-sets, P-information law discovery theorems which has attribute supplementing-deleting are given. Mining-discovery and mining-discovery theorems of unknown information law are proposed. Function P-sets are a new theory and new method to research dynamic information laws for information systems.展开更多
We show an example of a bounded potential on the half-line obtained as the image of an Inverse Transformation Operator of the Bessel singular potential of the Reduced Radial Schrödinger Equation, and show us ...We show an example of a bounded potential on the half-line obtained as the image of an Inverse Transformation Operator of the Bessel singular potential of the Reduced Radial Schrödinger Equation, and show us the Estimates of the A(α) amplitude.展开更多
基金the National Natural Science Foun-dation of China(Grant Nos.12204074,12222402,92365101,and 12347101)the Natural Science Foundation of Chong-ging(Grant No.CSTB2023NSCQ-JQX0024).
文摘The realization of 100%polarized topologicalWeyl fermions in half-metallic ferromagnets is of particular importance for fundamental research and spintronic applications.Here,we theoretically investigate the electronic and topological properties of the zinc-blende compound VAs,which was deemed as a half-metallic ferromagnet related to dynamic correlations.Based on the combination of density functional theory and dynamical mean field theory,we uncover that the half-metallic ferromagnet VAs exhibits attractive Weyl semimetallic behaviors which are very close to the Fermi level in the DFT+U regime with effect U values ranging from 1.5 eV to 2.5 eV.Meanwhile,we also investigate the magnetization-dependent topological properties;the results show that the change of magnetization directions only slightly affects the positions of Weyl points,which is attributed to the weak spin–orbital coupling effects.The topological surface states of VAs projected on semi-infinite(001)and(111)surfaces are investigated.The Fermi arcs of all Weyl points are clearly visible on the projected Fermi surfaces.Our findings suggest that VAs is a fully spin-polarized Weyl semimetal with many-body correlated effects in the effective U values range from 1.5 eV to 2.5 eV.
文摘Half-Heusler(HH)合金由于其本身具有较为优异的力学性能和高温热稳定性,已成为目前最具有应用前景的中高温热电材料之一。然而,其本身较高的本征晶格热导率阻碍了热电性能的进一步提升。本文以P型Zr Co Sb0.85Sn0.15合金为研究对象,基于同构合金化具有优异P型热电性能的(Nb0.8Ta0.2)0.8Ti0.2Fe Sb,通过磁悬浮熔炼和放电等离子烧结设计并制备出一种(Zr Co Sb0.85Sn0.15)1-x[(Nb0.8Ta0.2)0.8Ti0.2Fe Sb]x(x=0,0.2,0.3,0.4,0.5)高熵HH合金。微观组织分析表明,同构合金化这一策略引入了大量多尺度多衬度的第二相,这将有效增强对声子的散射。其中,当同构合金化含量为0.3时,晶格热导率在923 K时从Zr Co Sb0.85Sn0.15的4.72 W·m-1·K-1降至3.07 W·m-1·K-1,降低了35%。然而,由于多位点合金化元素间存在较为复杂的掺杂效果,使其电导率和塞贝克系数同时降低,最终导致热电优值存在一定的降低。本研究工作表明,高熵合金设计思想是一种降低HH热电合金晶格热导率的有力措施。
基金Supported by the Natural Science Foundation of Zhumadian, Henan, China(11704)Supported by the National Natural Science Foundation of Shandong Province(60973042)Supported by the Natural Science Foundation of Shandong Province(Y2008F61, Y2008G20)
文摘P-sets is a set pair, it is composed of internal P-set and outer P-set, it has dynamic characteristic. By using structure of P-sets, dependence theorem and identification theorem are proposed in this paper.
基金Supported by the Elementary and Advanced Technology Foundation of Henan Province(082300410040, 102300410153)
文摘Function P-sets are a set pair which are composed of function internal packetsets S F and function outer packet sets S F or (S F , S F ) are function P-sets. Function P-sets have dynamic characteristics and law characteristics. Based on function P-sets, P-information law discovery theorems which has attribute supplementing-deleting are given. Mining-discovery and mining-discovery theorems of unknown information law are proposed. Function P-sets are a new theory and new method to research dynamic information laws for information systems.
文摘We show an example of a bounded potential on the half-line obtained as the image of an Inverse Transformation Operator of the Bessel singular potential of the Reduced Radial Schrödinger Equation, and show us the Estimates of the A(α) amplitude.
