期刊文献+
共找到141篇文章
< 1 2 8 >
每页显示 20 50 100
Anisotropic Spin Cluster as a Qubit
1
作者 YAN Xiao-Bo WANG Ming-Ji Electronic Science Institute,Daqing Petroleum Institute,Daqing 163318,China 《Communications in Theoretical Physics》 SCIE CAS CSCD 2007年第7期90-92,共3页
We study an anisotropic spin cluster of 3 spin S=1/2 particles with antiferromagnetic exchange interactionwith non-uniform coupling constants.A time-dependent magnetic field is applied to control the time evolution of... We study an anisotropic spin cluster of 3 spin S=1/2 particles with antiferromagnetic exchange interactionwith non-uniform coupling constants.A time-dependent magnetic field is applied to control the time evolution of thecluster.It is well known that for an odd number of sites a spin cluster qubit can be defined in terms of the ground statedoublet.The universal one-qubit logic gate can be constructed from the time evolution operator of the non-autonomousmany-body system,and the six basic one-qubit gates can be realized by adjusting the applied time-dependent magneticfield. 展开更多
关键词 algebraic dynamics anisotropic spin cluster universal one-qubit logic gate
下载PDF
Spin-cluster glass state in U(Ga0.95Mn0.05)3
2
作者 谢东华 张文 +8 位作者 刘毅 冯卫 张云 谭世勇 朱燮刚 陈秋云 刘琴 袁秉凯 赖新春 《Chinese Physics B》 SCIE EI CAS CSCD 2016年第4期365-369,共5页
We report the study of a low temperature cluster glass state in 5% Mn-doped UGa3 heavy fermion compound. This compound transforms from a paramagnetic state to a spin-cluster glass state, which is confirmed by measurin... We report the study of a low temperature cluster glass state in 5% Mn-doped UGa3 heavy fermion compound. This compound transforms from a paramagnetic state to a spin-cluster glass state, which is confirmed by measuring the dc susceptibility and magnetization. The ac susceptibility exhibits a frequency-dependent peak around Tf, which provides direct evidence of the cluster glass state. By analyzing the field-dependent magnetization and frequency-dependent ac susceptibility in detail, we deduce that this compound forms a spin-cluster glass state below Tf. 展开更多
关键词 spin-cluster glass U(Ga0.95Mn0.05)3 magnetic properties
下载PDF
Large-scale cluster state generation with nuclear spins in diamonds
3
作者 陈琼 冯芒 +1 位作者 杜江峰 海文华 《Chinese Physics B》 SCIE EI CAS CSCD 2011年第1期142-149,共8页
The cluster state is an indispensable resource for one-way quantum computing (lWQC). We propose a practical scheme for constructing cluster states among nuclear spins in nitrogen-vacancy defect centres (NV centres... The cluster state is an indispensable resource for one-way quantum computing (lWQC). We propose a practical scheme for constructing cluster states among nuclear spins in nitrogen-vacancy defect centres (NV centres) in different diamonds. The entanglement of nuclear spins within an NV centre is made by hyperfine coupling via electron spin, and the entanglement between remote NV centres is accomplished using the parity projection of emitted photons. We discus the possibility to build large-scale nuclear-spin cluster states with diamonds. 展开更多
关键词 nitrogen-vacancy defect centre cluster state nuclear spin
下载PDF
Electron Spin Resonance(ESR)Spectroscopy of the Transition-metal Complexes and Clusters I.Systematic Investigations of Real-and Complex-Orbital Methods for Calculating the d-Orbital Energies of a Low-spin(S=1/2)nd^5(t_2~5,~2T_2)(n=3
4
作者 ZHAO Kun (Fujian Institute of Research on the Structure of Matter, the Chinese Academy of Sciences, Fuzhou, Fujian, China 350002) 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 1999年第2期61-65,共5页
On the basis of the first paper’s theoretical derivations and concrete instance calculations of the energies of the d orbitals for a low spin ( S =1/2) nd 5(t 2 5, 2T 2)(n =3, 4, 5) system, the ma... On the basis of the first paper’s theoretical derivations and concrete instance calculations of the energies of the d orbitals for a low spin ( S =1/2) nd 5(t 2 5, 2T 2)(n =3, 4, 5) system, the major results reported in this paper contain the following two respects: explicit relationships between the coefficients of the real and complex Kramers doublets have been derived by using two types of the expressions of the principal components of the g tensors in real and complex orbital representations obtained in the first paper; the use of these relationships of the real and complex orbital coefficients has carried out a series of mathematical demonstrations on the agreement of the real and complex orbital methods . 展开更多
关键词 ESR transition metal complexes and clusters low spin d 5 systems
下载PDF
Spin Dependent Hopping in Ti Doped La_(0.67)Ca_(0.33)MnO_3 被引量:1
5
作者 黄宝歆 刘宜华 +3 位作者 张汝贞 原晓波 王成建 梅良模 《Journal of Rare Earths》 SCIE EI CAS CSCD 2004年第6期803-807,共5页
A systematic investigation of the magnetic and transport properties of Ti doped La_(0.67)Ca_(0.33)MnO_3 was reported. The Ti substitution for Mn ions results in a reduction in ferromagnetism and conductivity. The meta... A systematic investigation of the magnetic and transport properties of Ti doped La_(0.67)Ca_(0.33)MnO_3 was reported. The Ti substitution for Mn ions results in a reduction in ferromagnetism and conductivity. The metal-insulator transition temperature is close to Curie temperature which decreases from 274 to 82 K as x increases from 0 to 0.17. The most important effect of Ti doping is to introduce spin clusters in the samples due to the distortion of local lattice and the inhomogeneous magnetic structure induced primarily by the random distribution of Mn ions. A maximum magnetoresistance ratio as large as 90% in 1 T at 122 K was obtained for the sample with x=0.055, which is four times larger than that obtained for LCMO sample at 272 K. There is a remarkable field-history dependent MR in the cooling process for the doped samples while such phenomenon disappears in the warming run. The resistivity follows well the variable range hopping behavior in paramagnetic state. Both the size effect and spin dependent hopping of carriers between the spin clusters should be considered in this system. 展开更多
关键词 ceramic materials colossal magnetoresistance spin cluster rare earths
下载PDF
无线传感器网络的SPIN协议研究 被引量:3
6
作者 王春 罗惠琼 《十堰职业技术学院学报》 2004年第2期60-62,共3页
 无线传感器网络是计算机科学技术的一个新的研究领域,是传感器技术、嵌入式计算技术、分布式信息处理技术和无线通信技术相结合的产物,具有广阔的理论研究和应用前景。本文对一种无线传感器网络路由协议SPIN-PP作了分析,并针对无线传...  无线传感器网络是计算机科学技术的一个新的研究领域,是传感器技术、嵌入式计算技术、分布式信息处理技术和无线通信技术相结合的产物,具有广阔的理论研究和应用前景。本文对一种无线传感器网络路由协议SPIN-PP作了分析,并针对无线传感器网络的特点对其进行了一些改进工作,经NS2上的仿真结果表明这是一种有效的改进方案。 展开更多
关键词 无线传感器网络 spin协议 路由协议 网络层
下载PDF
理论研究IIB族金属二氢化物分子的基态性质
7
作者 张志鹏 杨培龙 +1 位作者 涂喆研 李仁忠 《原子与分子物理学报》 CAS 北大核心 2025年第3期1-7,共7页
基于小核能量一致性相对论赝势,采用密度泛函理论和耦合簇理论,分别在标量和二分量水平上计算研究了MH_(2)(M=Zn,Cd,Hg,Cn)分子的平衡键长和振动频率.计算结果显示,HgH_(2)和CnH_(2)的自旋轨道耦合效应较为明显.采用的8种泛函总体较好... 基于小核能量一致性相对论赝势,采用密度泛函理论和耦合簇理论,分别在标量和二分量水平上计算研究了MH_(2)(M=Zn,Cd,Hg,Cn)分子的平衡键长和振动频率.计算结果显示,HgH_(2)和CnH_(2)的自旋轨道耦合效应较为明显.采用的8种泛函总体较好地评估了自旋轨道耦合效应.耦合簇理论计算的ZnH_(2)、CdH_(2)、HgH_(2)的键长和Σ_(u)振动频率与实验值偏差略大,这可能是由于其多参考态特性较明显.二分量PBE泛函计算的键长和Σ_(u)振动频率与实验值最接近.目前最重的CnH_(2)相关研究未见报道,研究给出了其键长和振动频率的理论值. 展开更多
关键词 金属二氢化物 密度泛函理论 耦合簇理论 标量相对论 自旋轨道耦合
下载PDF
团簇FePS_(3)的电子性质及反应活性密度泛函研究
8
作者 魏代霞 方志刚 +3 位作者 吴庭慧 宋静丽 刘立娥 原琳 《北京化工大学学报(自然科学版)》 CAS CSCD 北大核心 2024年第2期40-47,共8页
以团簇FePS_(3)为局域模型,在B3LYP/def2-tzvp水平下采用Gaussian 09程序对团簇FePS_(3)进行结构优化及虚频验证,获得12种稳态构型,分析了这12种构型的原子电荷量、电子自旋密度及反应活性。结果表明:团簇FePS_(3)中S原子为电子受体,Fe... 以团簇FePS_(3)为局域模型,在B3LYP/def2-tzvp水平下采用Gaussian 09程序对团簇FePS_(3)进行结构优化及虚频验证,获得12种稳态构型,分析了这12种构型的原子电荷量、电子自旋密度及反应活性。结果表明:团簇FePS_(3)中S原子为电子受体,Fe、P原子为电子供体,Fe比P原子更容易失去电子,团簇FePS_(3)整体的电子流向为从Fe、P原子流入S原子;Fe、P原子间和Fe、S原子间的过剩电子主要为自旋向下的β成单电子,P、S原子间和S、S原子间的过剩电子主要为自旋向上的α成单电子;构型4(4)、2(2)、1(2)、2(4)、1(4)和4(2)的电子自旋密度的对称性最好,稳定性最高,因此这6种构型可能为团簇FePS_(3)的优势构型;构型6(2)的前线轨道(HOMO-LUMO)能隙差最小,最容易发生电子跃迁,反应活性最高;构型2(4)的HOMO-LUMO轨道能隙差最大,反应活性最低。 展开更多
关键词 团簇FePS_(3) 密度泛函理论 电荷量 自旋密度 反应活性
下载PDF
范德华体系以外配位化合物的自旋轨道耦合研究:决定^(2)P_(3/2)态进一步裂分的关键因素
9
作者 曹文锦 王学斌 《Chinese Journal of Chemical Physics》 SCIE EI CAS CSCD 2024年第2期295-302,I0002-I0004,I0103,共12页
本文报道了一项联合光电子能谱和理论计算的研究,探索碘原子与氩原子、氢氟酸、甲酸/乙酸、甘氨酸/甲基化甘氨酸衍生物等分子结合形成的配位化合物中的自旋轨道耦合现象.L.I^(-)(L=甲酸/乙酸化合物的低温光电子谱都呈现了三个清晰分辨... 本文报道了一项联合光电子能谱和理论计算的研究,探索碘原子与氩原子、氢氟酸、甲酸/乙酸、甘氨酸/甲基化甘氨酸衍生物等分子结合形成的配位化合物中的自旋轨道耦合现象.L.I^(-)(L=甲酸/乙酸化合物的低温光电子谱都呈现了三个清晰分辨的波峰,标识了三个自旋轨道耦合态的存在:分别为相应中性化合物中的X(1/2)、A(3/2)和B(1/2)态.X和A态的间距△E_(XA)都为0.10eV,而X和B态的间距△E_(XB)则分别为0.98和0.97eV.本文测得的裂分间距值与先前报道的不同的L·I^(·)(L=氩原子、氢氟酸、甘氨酸和甲基化甘氨酸)的值进行了比较,从而得出了涵盖以范德华力和由弱至强的氢键等多样的分子间相互作用为主导的化合物的自旋轨道耦合裂分规律:尽管不同类型化合物的△E_(XB)比较相似,但△E_(XA)对于配体类型和相互作用类型极其敏感,其数值范围涵盖了从5meV到150meV的跨度.总体而言,实验测得的自旋轨道耦合裂分间距与通过量子化学计算所得数值高度吻合,表明了△E_(XA)的大小与中性化合物的分子间相互作用强度成正相关而与键长成反比. 展开更多
关键词 自旋轨道耦合 光电子能谱 氢键配位化合物
下载PDF
Quantum Curie-Weiss Magnet Induced by Violation of Cluster Property 被引量:1
10
作者 Tomo Munehisa 《World Journal of Condensed Matter Physics》 2020年第2期27-52,共26页
There are some concepts that are accepted in our daily life but are not trivial in physics. One of them is the cluster property that means there exist no relations between two events which are sufficiently separated. ... There are some concepts that are accepted in our daily life but are not trivial in physics. One of them is the cluster property that means there exist no relations between two events which are sufficiently separated. In the works recently published by the author, the extensive and quantitative examination has been made about the violation of cluster property in the correlation function of the spin operator for the quantum spin system. These works have shown that, when we include the symmetry breaking interaction, the effect by the violation is proportional to the inverse of the system size. Therefore this effect is tinny since the system size is quite large. In order to find the effect due to the violation even when the size is large, we propose a new system where additional spins couple with the spin system on the square lattice, where the coupling constant between these systems being assumed to be small. Applying the perturbation theory, we obtain the effective Hamiltonian for the additional system. This Hamiltonian includes Curie-Weiss model that is induced by the violation of the cluster property. Then we find that this effective Hamiltonian has the factor which is the inverse of the system size. Since Curie-Weiss model, which is known to be exactly soluble, has to contain this factor so that the thermodynamical properties are well-defined, the essential factor for the Hamiltonian is determined by the coupling and the strength of the symmetry breaking interaction. Our conclusion is, therefore, that it is possible to observe the effect by the violation of the cluster property at the inverse temperature whose order is given by these parameters. 展开更多
关键词 QUANTUM spin SPONTANEOUS Symmetry Breaking cluster PROPERTY Curie-Weiss Model
下载PDF
ADF Studies of Neutral Small C_n(n=3~6)High-symmetry Clusters
11
作者 HUANG Xin\ LI Jun Qian ② (Department of Chemistry, Fuzhou University, Fuzhou, 350002, China) (State Key Laboratory of Structural Chemistry, Fuzhou, 350002, China) 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 2000年第3期168-173,共6页
The geometries, electronic structures of pure carbon clusters were investigated in the range of C 3 to C 6 size. To obtain accurate results, the STO double zeta basis sets with a polarization function are selected. Th... The geometries, electronic structures of pure carbon clusters were investigated in the range of C 3 to C 6 size. To obtain accurate results, the STO double zeta basis sets with a polarization function are selected. The main focuses are on the new geometry, electronic structures of carbon clusters, such as the three dimensional structure for C 4, C 5 and so on. The clusters are found to have more isomers corresponding to different geometries and spin multiplicities close to their ground states. We find that the spin multiplicity of the ground state or close to ground state of odd numbered linear chain is 1. But in even numbered linear chains, the spin multiplicity is 3. In odd numbered cyclic structure without branch chain, the spin multiplicity of the ground state or close ground state is 3, and that of even numbered is 1. But the three dimensional structure disagree those principles. 展开更多
关键词 SMALL carbon clusterS density function geometry eletronic structure spin MULTIPLICITY
下载PDF
FUZZY DECISION-MAKING OF COMBING ROLLER COVERING FOR SPINNING PURE RAMIE NOIL ROTOR-SPUN YARNS
12
作者 黄秀宝 林廷坤 《Journal of China Textile University(English Edition)》 EI CAS 1993年第1期1-9,共9页
This paper deals with the types and specifications of combing roller covering for spinning pureramie noil rotor-spun yarns.A handling mode combining Fuzzy Decision-making and FuzzyCluster Analysis has been used for an... This paper deals with the types and specifications of combing roller covering for spinning pureramie noil rotor-spun yarns.A handling mode combining Fuzzy Decision-making and FuzzyCluster Analysis has been used for analyzing the experimental results.It is shown that,with regard to the specifications of the sawtooth clothing of the combing rol-ler,large working angle,large tooth pitch,fine tooth shape,short tooth height,smooth finish andgood wearability are of benefit to improving the spinning stability and the spun yarn properties.The pinned combing roller,however,regardless of its complicated process of production,is sug-gested to be preferred for spinning the pure ramie noil rotor-spun yarns.The handling mode used in this work is efficient in improving the reliability and objectivity ofthe conclusions and can be used for solving the similar problems. 展开更多
关键词 RAMIE COMBING rollers metallic clothing FUZZY decision FUZZY cluster analysis RAMIE NOIL rotor spinNING
下载PDF
EPR Study of a New Crystal of the Binuclear Copper(Ⅱ) Cluster Compound-〔Cu2(α-C10H7CH2CO2)4-(DMF)2〕·(DMF)2·H2O
13
《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 1994年第1期9-15,共页
In this paper, single crystal EPR study of a new binuclear copper (Ⅱ) cluster compound-[Cu2(α-C(10) H7CH2CO2)4 (DMF)2]·[DMF]2·H2O](DMF= (CH3)2NCOH) at room temperature is reported. The lines of △Ms=±... In this paper, single crystal EPR study of a new binuclear copper (Ⅱ) cluster compound-[Cu2(α-C(10) H7CH2CO2)4 (DMF)2]·[DMF]2·H2O](DMF= (CH3)2NCOH) at room temperature is reported. The lines of △Ms=±1 allowing transition and △M=2 forbiding transition are shown in EPR spectra. The experimental data are consistent with the calculated results by the leastsquares fitting prograrn in three principal planes of g and D tensors. The spin Hamiltonian parameters are as follows: gx=2. 1482, gy=2. 0529 ,gz=2. 3905, D= 0. 348 cm ̄(-1) and E =0. 01 cm-1. The diagrams of the energy levels have been obtained when the magnetic field is oriented to three principal axes. The polycrystal EPR spectra have been measured at room temperature and 77K, respectively.and the parameters of these spectra are given (g∥= 2. 094, g⊥= 2. 425, D= 0. 37 cm-1,E=0). The parameter of the isotropic magnetic exchange interaction J=-254cm-1 is determined, and that of the anisotropic magnetic exchange J1=-153 cm-1 is calculated. The average magnetic susceptibility of the polycrystal sample χ= 1. 39 ×10-6 (c. g. s) has been measured by Faraday powder method. Thus the average magnetic mornent μ=1. 43 B. M. can be calculated. It is shown that the exchange interactions between the metal ions of the binuclear copper(Ⅱ) cluster compound are confirmed antiferromagnetic In nature. 展开更多
关键词 EPR spectroscopic binuclear copper cluster spin parameter magnetic exchange
全文增补中
团簇Fe_(3)Ni_(3)的电子自旋及磁学性质
14
作者 郑新喜 方志刚 +2 位作者 王倩 许友 井润田 《哈尔滨理工大学学报》 CAS 北大核心 2023年第4期152-158,共7页
为探究非晶态合金Fe-Ni二元体系的电子自旋及其磁学性质,对其宏观优异磁学性能提供理论支撑,设计团簇Fe_(3)Ni_(3)作为局域结构模型,以密度泛函理论为基础,在B3LYP/Lanl2dz(level)下对其进行全参数优化计算,最终得到5种三重态优化构型... 为探究非晶态合金Fe-Ni二元体系的电子自旋及其磁学性质,对其宏观优异磁学性能提供理论支撑,设计团簇Fe_(3)Ni_(3)作为局域结构模型,以密度泛函理论为基础,在B3LYP/Lanl2dz(level)下对其进行全参数优化计算,最终得到5种三重态优化构型。从各优化构型Mulliken自旋布居数的角度对其成单电子分布情况进行分析,再通过各构型的电子自旋密度、磁矩及轨道态密度对其磁学性质进行研究。结果表明:团簇Fe_(3)Ni_(3)所有优化构型中,各原子的成单电子主要分布在d轨道,Fe原子的成单电子均多于Ni原子且自旋方向相反,同时Fe原子对团簇磁性的贡献也大于Ni原子;团簇Fe_(3)Ni_(3)的d轨道对该团簇磁性起主要贡献作用;其部分s、p轨道特定能量片段上的α、β电子可以发生自旋相互耦合进而转换。 展开更多
关键词 团簇 成单电子 电子自旋 磁矩 态密度
下载PDF
二维反铁磁体FePS_(3)的磁学性质研究
15
作者 魏代霞 方志刚 +3 位作者 宋静丽 朱依文 刘立娥 原琳 《辽宁科技大学学报》 CAS 2023年第3期196-204,共9页
为了研究团簇FePS_(3)的磁学性质,以密度泛函理论为依据,在B3LYP/def2-tzvp水平下,对团簇FePS_(3)进行程序运行,得到二重态和四重态各6种优化构型。对团簇FePS_(3)的自旋布居数、磁矩和电子自旋密度差图等分析表明,四重态构型对团簇FePS... 为了研究团簇FePS_(3)的磁学性质,以密度泛函理论为依据,在B3LYP/def2-tzvp水平下,对团簇FePS_(3)进行程序运行,得到二重态和四重态各6种优化构型。对团簇FePS_(3)的自旋布居数、磁矩和电子自旋密度差图等分析表明,四重态构型对团簇FePS_(3)磁性的贡献优于二重态构型。团簇FePS_(3)的磁性主要由各构型d轨道上的α电子贡献,s、p、f轨道上的成单电子对团簇磁性作用也不可忽略。团簇FePS_(3)中各原子对磁性贡献率顺序为:Fe原子>S原子>P原子。金属Fe原子对团簇FePS_(3)的磁性起主要作用,且自旋向上的α电子占团簇FePS_(3)磁性的主导地位。 展开更多
关键词 团簇FePS_(3) 磁性 自旋布居数 态密度 密度泛函
下载PDF
团簇Con MoS(n=1~5)密度泛函理论分析:稳定性及电子性质
16
作者 王智瑶 方志刚 +5 位作者 王洁 毛智龙 曾鑫渔 刘立娥 吴庭慧 宋嘉 《安徽大学学报(自然科学版)》 CAS 北大核心 2023年第2期74-83,共10页
为深入探究团簇ConMoS(n=1~5)的稳定性和电子性质,弄清其微观结构和电子变化状况,根据密度泛函和团簇模型理论,在B3LYP/def2-TZVP量化水平和多个自旋多重度下对该系列团簇进行结构优化和分析.结果表明:最终得到21种团簇稳定构型,大多以... 为深入探究团簇ConMoS(n=1~5)的稳定性和电子性质,弄清其微观结构和电子变化状况,根据密度泛函和团簇模型理论,在B3LYP/def2-TZVP量化水平和多个自旋多重度下对该系列团簇进行结构优化和分析.结果表明:最终得到21种团簇稳定构型,大多以立体结构存在;从碎裂能和每原子结合能角度得知,团簇成长时不断获取能量,且团簇Co_(3)MoS表现出了比相邻团簇较好的稳定性;由NPA电荷可知,Co原子是电子供体,S原子是电子受体,Mo原子情形复杂,提供和接受电子情况都存在;分析自然电子组态可知,原子外层轨道和高能级轨道存在不同的得失电子情形,且该系列团簇原子和原子间皆发生了不同程度的轨道杂化现象. 展开更多
关键词 团簇Con MoS 碎裂能 NPA电荷 电子自旋密度
下载PDF
团簇MnPS_(3)磁学性质分析
17
作者 原琳 方志刚 +2 位作者 宋静丽 刘立娥 魏代霞 《扬州大学学报(自然科学版)》 CAS 北大核心 2023年第1期33-39,共7页
为探究团簇MnPS_(3)的磁学性质,设计了团簇MnPS_(3)的初始构型,并运用密度泛函理论(density functional theory,DFT)在B3LYP/def2-tzvp水平下对其进行优化处理,最终得到6种单重态和3种三重态稳定构型.利用Multiwfn程序计算团簇MnPS_(3)... 为探究团簇MnPS_(3)的磁学性质,设计了团簇MnPS_(3)的初始构型,并运用密度泛函理论(density functional theory,DFT)在B3LYP/def2-tzvp水平下对其进行优化处理,最终得到6种单重态和3种三重态稳定构型.利用Multiwfn程序计算团簇MnPS_(3)三重态构型的成单电子数、自旋布居数、自旋磁矩、轨道态密度及电子自旋密度差等磁性相关数据.结果表明,各轨道对团簇MnPS_(3)磁性的贡献大小为d轨道>p轨道>s轨道>f轨道;金属Mn原子对团簇MnPS_(3)磁性的影响较大,非金属原子P和S对团簇MnPS_(3)磁性的影响较小;d轨道态密度图对称性较差,且对应峰值相差较大,故d轨道是团簇MnPS_(3)磁性的主要贡献者. 展开更多
关键词 团簇MnPS_(3) 态密度 磁性 磁矩 自旋布居数
下载PDF
Improvement on Electrical Properties and Magnetoresistance Induced by Pd or Ag Addition in Lao.67(Ca0.65Ba0.35)0.33MnO3 Manganites
18
作者 原晓波 任俊峰 《Chinese Journal of Chemical Physics》 SCIE CAS CSCD 2013年第4期431-438,J0002,共9页
Electrical properties and magnetoresistance have been studied in two series of xAg-La0.67(Ca0.65Ba0.35)0.33MnO3 and xPd-La0.67(Ca0.65Ba0.35)0.33MnO3 (abbreviated by xAg-LCBMO and xPd-LCBMO) composites. Both Pd a... Electrical properties and magnetoresistance have been studied in two series of xAg-La0.67(Ca0.65Ba0.35)0.33MnO3 and xPd-La0.67(Ca0.65Ba0.35)0.33MnO3 (abbreviated by xAg-LCBMO and xPd-LCBMO) composites. Both Pd and Ag addition induce a decrease in resistivity and an increase in temperature at which the resistivity reaches its maximum. This is mainly due to the improvement of grain boundaries caused by the segregation of good conductive metal grains on the grain boundaries/surfaces. In addition, both Pd and Ag addition induce a large enhancement of room temperature magnetoresistance (RTMR). Note that 27% molar ratio of Ag addition induces a large RTMR of about 70%, about ten times larger than pure LCBMO, whereas 27% molar ratio Pd addition brings a much larger RTMR of about 170%. The large enhancements of MR can be attributed to the decrease in resistivity of the samples caused by the good conductive metal. On the other hand, the polarization of Pd atoms near the Mn ions on the grain surfaces/boundaries plays a very im-portant role in the increase in MR, which induces a large number of spin clusters in Pd-added samples. 展开更多
关键词 Colossal magnetoresistance Ag-added manganite Pd-added manganite Roomtemperature magnetoresistance spin cluster Polarization of Pd atom
下载PDF
双层锰氧化物NdSr_2Mn_2O_7的磁性和自旋玻璃行为 被引量:4
19
作者 邢茹 赵建军 +2 位作者 鲁毅 郑琳 吴鸿业 《内蒙古师范大学学报(自然科学汉文版)》 CAS 2011年第6期583-585,共3页
通过固相反应法制备了多晶样品NdSr2Mn2O7,利用XRD和SQUID研究了样品的结构和磁性.结果表明,该样品的单相性很好,单相结构为Sr3Ti2O7四角型结构(14/mmm).磁性测量表明,温度高于居里温度(TC=275K)时,样品呈现顺磁性,随着温度的降低,发生... 通过固相反应法制备了多晶样品NdSr2Mn2O7,利用XRD和SQUID研究了样品的结构和磁性.结果表明,该样品的单相性很好,单相结构为Sr3Ti2O7四角型结构(14/mmm).磁性测量表明,温度高于居里温度(TC=275K)时,样品呈现顺磁性,随着温度的降低,发生顺磁-铁磁的转变.当温度降到150K时,零场冷却出现了一个峰值,表明样品具有自旋玻璃行为.自旋玻璃行为主要是团簇间的相互作用和自旋玻璃相共同作用的结果. 展开更多
关键词 锰氧化物 自旋玻璃 铁磁团簇
下载PDF
FeB_N(N≤3)团簇的结构与磁性 被引量:3
20
作者 闫玉丽 赵文杰 +2 位作者 高丽珍 侯卫周 王渊旭 《原子与分子物理学报》 CAS CSCD 北大核心 2008年第3期590-594,共5页
基于第一性原理,利用密度泛函理论中的广义梯度近似(GGA)对FeBN(N≤3)团簇进行了结构优化、能量和频率的计算,得到了FeBN(N≤3)团簇在不同自旋多重度下的平衡结构并确定了团簇的基态构型.结果表明,FeBN(N≤3)基态团簇的自旋多重度分别为... 基于第一性原理,利用密度泛函理论中的广义梯度近似(GGA)对FeBN(N≤3)团簇进行了结构优化、能量和频率的计算,得到了FeBN(N≤3)团簇在不同自旋多重度下的平衡结构并确定了团簇的基态构型.结果表明,FeBN(N≤3)基态团簇的自旋多重度分别为4、3、2.我们对FeBN基态团簇的磁性做了系统的研究,得出了Fe原子磁矩和团簇总磁矩随团簇尺寸增大而减小的结论. 展开更多
关键词 FeBN团簇 自旋多重度 磁矩 密度泛函理论
下载PDF
上一页 1 2 8 下一页 到第
使用帮助 返回顶部