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The honeycomb compound $\alpha$-RuCl$_3$ is widely discussed as a proximate Kitaev spin-liquid material. This scenario builds on spin-orbit entangled $j = 1/2$ moments arising for a $t_{2g}^5$ electron configuration with strong spin-orbit…

Strongly Correlated Electrons · Physics 2020-10-21 P. Warzanowski , N. Borgwardt , K. Hopfer , T. C. Koethe , P. Becker , V. Tsurkan , A Loidl , M. Hermanns , P. H. M. van Loosdrecht , M. Grüninger

The electronic structure and magnetism of chromia (corundum-type Cr2O3) are studied using full-potential first-principles calculations. The electronic correlations are included within the LSDA+U method. The energies of different magnetic…

Materials Science · Physics 2009-03-08 Siqi Shi , A. L. Wysocki , K. D. Belashchenko

Low temperature magnetization of CrI3, CrSiTe3 and CrGeTe3 single crystals were systematically studied. Based on the temperature dependence of extrapolated spontaneous magnetization from magnetic isotherms measured at different…

Materials Science · Physics 2021-05-26 Zhixue Shu , Tai Kong

{\bf R}-matrix calculations combined with the adiabatic nuclei approximation are used to compute electron-impact rotiational excitation rates for three closed-shell diatomic cations, HeH$^+$, CH$^+$, ArH$^+$. Comparisons with previous…

Astrophysics of Galaxies · Physics 2015-12-02 James R. Hamilton , Alexandre Faure , Jonathan Tennyson

Electronic structure and magnetic interactions of a Tb adatom on graphene are investigated from first principles using combination of density functional theory and multiconfigurational quantum chemistry techniques including spin-orbit…

Materials Science · Physics 2024-09-13 Monirul Shaikh , Alison Klein , Aleksander L. Wysocki

In RuCl$_3$, inelastic neutron scattering and Raman spectroscopy reveal a continuum of non-spin-wave excitations that persists to high temperature, suggesting the presence of a spin liquid state on a honeycomb lattice. In the context of the…

High spin systems, like those that incorporate rare-earth $4f$ elements (REEs), are increasingly relevant in many fields. Although research in such systems is sparse, the large Hilbert spaces they occupy are promising for many applications.…

Mesoscale and Nanoscale Physics · Physics 2023-08-16 David W. Facemyer , Naveen K. Dandu , Alex Taekyung Lee , Vijay R. Singh , Anh T. Ngo , Sergio E. Ulloa

Monolayer chromium trihalides, the archetypal two dimensional (2D) magnetic materials, are readily suggested as a promising platform for high frequency magnonics. Here we detail the spin wave properties of monolayer CrBr$_3$ and CrI$_3$,…

Coherent control of individual molecular spins in nano-devices is a pivotal prerequisite for fulfilling the potential promised by molecular spintronics. By applying electric field pulses during time-resolved electron spin resonance…

Inelastic neutron scattering reveals strong spin fluctuations with energies as high as 0.4eV in the nearly antiferromagnetic metal Cr$_{0.95}$V$_{0.05}$. The magnetic response is well described by a modified Millis-Monien-Pines function.…

Strongly Correlated Electrons · Physics 2009-10-31 S. M. Hayden , R. Doubble , G. Aeppli , T. G. Perring , E. Fawcett

We perform collective spin measurements to study the buildup of two-body correlations between $\approx10^4$ spin $s=3$ chromium atoms pinned in a 3D optical lattice. The spins interact via long range and anisotropic dipolar interactions.…

$\alpha$-RuCl$_3$ has been proposed recently as an excellent playground for exploring Kitaev physics on a two-dimensional (2D) honeycomb lattice. However, structural clarification of the compound has not been completed, which is crucial in…

Materials Science · Physics 2016-04-27 Heung-Sik Kim , Hae-Young Kee

Recent magnetic measurements on tetra-nickel molecular magnets [Ni(hmp)(ROH)Cl]$_4$, where R=CH$_3$, CH$_2$CH$_3$, or (CH$_2$)$_2$C(CH$_3$)$_3$ and hmp$^-$ is the monoanion of 2-hydroxymethylpyridine, revealed a strong exchange bias prior…

Materials Science · Physics 2009-11-10 Kyungwha Park , En-Che Yang , David N. Hendrickson

We investigate the structural, magnetocrystalline anisotropy, critical behaviour, and magnetocaloric effect in the layered room-temperature monoclinic ferromagnet Cr$_{1.38}$Te$_2$. The critical behavior is studied by employing various…

The van der Waals ferromagnet Cr$_2$Ge$_2$Te$_6$ (CGT) has a two-dimensional crystal structure where each layer is stacked through van der Waals force. We have investigated the nature of the ferromagnetism and the weak perpendicular…

$\gamma$-triclinic and $\alpha$-monoclinic polymorphs of CoV$_{2}$O$_{6}$ are two of the few known transition metal ion based materials that display stepped $1/3$ magnetization plateaus at low temperatures. Neutron diffraction [M. Markkula…

Strongly Correlated Electrons · Physics 2015-12-23 F. Wallington , A. M. Arevalo-Lopez , J. W. Taylor , J. R. Stewart , V. Garcia-Sakai , J. P. Attfield , C. Stock

The magnetic properties and electronic structure of the ground and excited states of two recently characterized endohedral metallo-fullerenes, [Gd$_2$@C$_{78}$]$^{-}$ (1) and [Gd$_2$@C$_{80}$]$^{-}$ (2), have been studied by theoretical…

Chemical Physics · Physics 2018-02-27 Akseli Mansikkamäki , Alexey A. Popov , Qingming Deng , Naoya Iwahara , Liviu F. Chibotaru

An exactly solvable spin-electron tetrahedral chain, where the Ising spins localized at nodal lattice sites regularly alternate with three equivalent lattice sites available for one mobile electron is considered. The system with…

Statistical Mechanics · Physics 2016-08-12 Lucia Galisova

Noncollinear spin textures in low-dimensional magnetic systems have been studied for decades because of their extraordinary properties and promising applications derived from the chirality and topological nature. However, material…

Mesoscale and Nanoscale Physics · Physics 2020-09-29 Xiaobo Lu , Ruixiang Fei , Linghan Zhu , Li Yang

Historically, finding two-dimensional (2D) magnets is well known to be a difficult task due to instability against thermal spin fluctuations. Metals are also normally considered poor thermoelectric (TE) materials. Combining intrinsic…