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The electronic structure of a monolayer of single-molecule magnets Mn$_{12}$ on a Au(111) surface is studied using spin-polarized density-functional theory. The Mn$_{12}$ molecules are oriented such that the magnetic easy axis is normal to…

材料科学 · 物理学 2010-01-28 Salvador Barraza-Lopez , Michael C. Avery , Kyungwha Park

We report on the structural and magnetic properties of single and double atomic layers of Mn on a clean and unreconstructed Nb(110) substrate. Low-temperature scanning tunneling spectroscopy measurements reveal a proximity-induced…

The magnetic properties of a monolayer of Mn12 single molecule magnets grafted onto a Si substrate have been investigated using depth-controlled $\beta$-detected nuclear magnetic resonance. A low energy beam of spin polarized radioactive…

We use neutron diffraction to probe the magnetization components of a crystal of Mn12 single-molecule magnets. Each of these molecules behaves, at low temperatures, as a nanomagnet with spin S = 10 and strong anisotropy along the…

介观与纳米尺度物理 · 物理学 2009-11-11 F. Luis , J. Campo , J. Gomez , G. J. McIntyre , J. Luzon , D. Ruiz-Molina

To investigate the detailed magnetic properties of a recently discovered superconducting nickelate Nd6Ni5O12, we performed the first-principles electronic structure calculation based on density functional theory. The band dispersion,…

超导电性 · 物理学 2024-10-02 Terri Yoon , Myung Joon Han

We examine the adsorption of a single Ni atom on a monolayer of MgO on a Ag substrate using DFT and DFT+U computational approaches. We find that the electronic and magnetic properties vary considerably across the three binding sites of the…

材料科学 · 物理学 2015-06-18 Oliver R. Albertini , Amy Y. Liu , Barbara A. Jones

The magnetic coupling between doped Mn atoms in clusters as well as crystals of GaN has been studied from first principles using molecular orbital theory for clusters and linearized muffin tin orbitals-tight binding formulation (LMTO-TB)…

材料科学 · 物理学 2009-11-07 G. P. Das , B. K. Rao , P. Jena

Understanding the magnetic properties of the various Mn doping configurations that can be encountered in $2H$-MoS$_2$ monolayer could be beneficial for its use in spintronics. Using density functional theory plus Hubbard U (DFT$+$U)…

材料科学 · 物理学 2019-09-04 Adlen Smiri , Iann Gerber , Samir Lounis , Sihem Jaziri

The electronic and magnetic properties of Mn coordinated to 1,2,4,5-tetracyanobenzene (TCNB) in the Mn-TCNB 2D metal-ligand networks have been investigated by combining scanning tunneling microscopy and X-ray magnetic circular dichroism…

Antiferromagnetic interlayer coupling in dilute magnetic semiconductor superlattices could result in the realisation of large magnetoresistance effects analogous to the giant magnetoresistance seen in metallic multilayer structures. In this…

材料科学 · 物理学 2010-10-29 A. D. Giddings , T. Jungwirth , B. L. Gallagher

We investigated the magnetic properties of two isostructural Ni(II) metal complexes [Ni4Lb8] and [Ni4Lc8]. In each molecule the four Ni(II) centers form almost perfect regular squares. Magnetic coupling and anisotropy of single crystals…

强关联电子 · 物理学 2009-11-10 R. Koch , O. Waldmann , P. Mueller , U. Reimann , R. W. Saalfrank

Magnetism in Ni-Mn-Z (Z = Ga,In,Sn,Sb) Heusler alloys has so far been predominantly attributed to Rudermann-Kittel-Kasuya-Yoshida type interactions between Mn atoms. We investigate magnetic interactions in one such alloy,…

材料科学 · 物理学 2015-06-15 K. R. Priolkar , P. A. Bhobe , D. N. Lobo , S. W. D'Souza , S. R. Barman , A. Chakrabarti , S. Emura

The magnetic state and magnetic coupling of individual atoms in nanoscale structures relies on a delicate balance between different interactions with the atomic-scale surrounding. Using scanning tunneling microscopy, we resolve the…

介观与纳米尺度物理 · 物理学 2015-06-12 T. R. Umbach , M. Bernien , C. F. Hermanns , A. Krüger , V. Sessi , I. Fernandez-Torrente , P. Stoll , J. I. Pascual , K. J. Franke , W. Kuch

The structural and magnetic properties of a series of superlattices consisting of two ferromagnetic metals La$_{0.7}$Sr$_{0.3}$MnO$_3$ (LSMO) and SrRuO$_3$ (SRO) grown on (001) oriented SrTiO$_3$ are studied. Superlattices with a fixed LSMO…

材料科学 · 物理学 2009-11-11 P. Padhan , W. Prellier , R. C. Budhani

A new high symmetry Mn12 oxocarboxylate cluster [Mn12O12(CN-o-C6H4CO2)12(CH3CO2)4(H2O)4]*8CH2Cl2 (1) with mixed carboxylate ligands is reported. It was synthesized by the standard carboxylate substitution method. 1 crystallizes in the…

We report the coexistence of ferromagnetic and antiferromagnetic phases in the single crystal of Mn$_3$ single-molecule magnet. The coexistent state appears within a certain period of time in the progress of either oxidation or reduction…

介观与纳米尺度物理 · 物理学 2015-01-23 Yan Cui , Yan-Rong Li , Rui-Yuan Liu , Zhen-Yu Mi , Yun-Ping Wang

Doped transition-metal dichalcogenides monolayers exhibit exciting magnetic properties for the benefit of two-dimensional spintronic devices. Using density functional theory (DFT) incorporating Hubbard-type of correction (DFT$+U$) to…

材料科学 · 物理学 2021-05-12 Adlen Smiri , Sihem Jaziri , Samir Lounis , Iann C. Gerber

The feasibility of a single-domain ferromagnet based on uniaxial magnetic ions was examined. For a noncentrosymmetric uniaxial magnetic ion of magnetic moment at a site of local electric dipole moment p, it is unknown to date whether the…

强关联电子 · 物理学 2017-05-01 Hyun-Joo Koo , Elijah E. Gordon , Myung-Hwan Whangbo

In nanocontacts between normal and ferromagnetic metals (N--F) abrupt changes of the order of 1% are detected in differential resistance, dV/dI(V), versus bias voltage, V, on achieving of high current densities, ~10^9 A/cm^2. These features…

The magnetic properties of Nd${}_2$Fe${}_{14}$B (NFB)/transition metal (TM = Fe, Co) multilayer systems are studied on the basis of first-principles density functional calculations. We optimize the model structure under a variety of…

介观与纳米尺度物理 · 物理学 2016-01-13 Nobuyuki Umetsu , Yuta Toga , Akimassa Sakuma
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