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Related papers: Large yet bounded: Spin gap ranges in carbenes

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Weakly interacting Fermi gases exhibit rich collective dynamics in spin-dependent potentials, arising from correlations between spin degrees of freedom and conserved single atom energies, offering broad prospects for simulating many-body…

Quantum Gases · Physics 2021-01-28 S. Pegahan , J. Kangara , I. Arakelyan , J. E. Thomas

The buffer carbon layer obtained in the first instance by evaporation of Si from the Si-rich surfaces of silicon carbide (SiC) is often studied only as the intermediate to the synthesis of SiC supported graphene. In this work, we explore…

Mesoscale and Nanoscale Physics · Physics 2018-07-31 Tommaso Cavallucci , Valentina Tozzini

Kitaev interactions underlying a quantum spin liquid have been long sought, but experimental data from which their strengths can be determined directly is still lacking. Here, by carrying out inelastic neutron scattering measurements on…

An inelastic neutron scattering study was performed on a Zn-substituted spin-1/2 Heisenberg 2-leg ladder compound Sr(Cu1-xZnx)2O3 (x < 0.04) to investigate nonmagnetic impurity effects on the quantum spin system with a large spin gap of…

Condensed Matter · Physics 2009-10-30 M. Azuma , M. Takano , R. S. Eccleston

The magnetic field dependence of the electronic properties of \textit{real} single vertical quantum dots in circular and rectangular mesas is investigated within a full three-dimensional multiscale self-consistent approach without any {\it…

Hydrogenated graphene, graphane, is studied on oxygen-terminated silicon dioxide substrate using ab initio calculations. A structure with hydrogenation only on one side of the graphene layer is found stable and its hydrogen configurations…

Mesoscale and Nanoscale Physics · Physics 2011-07-13 M. Ijäs , P. Havu , A. Harju , P. Pasanen

Plumbene, similar to silicene, has a buckled honeycomb structure with a large band gap ($\sim 400$ meV). All previous studies have shown that it is a normal insulator. Here, we perform first-principles calculations and employ a sixteen-band…

Materials Science · Physics 2017-03-28 Xiang-Long Yu , Li Huang , Jiansheng Wu

Strong interactions between electrons in two dimensions can realize phases where their spins and charges separate. We capture this phenomenon within a dual formulation. Focusing on square lattices, we analyze the long-wavelength structure…

Strongly Correlated Electrons · Physics 2022-11-28 Eyal Leviatan , David F. Mross

An accurate determination of singlet-triplet gaps in biradicals, including cyclobutadiene in the automerization barrier region where one has to balance the substantial nondynamical many-electron correlation effects characterizing the…

Chemical Physics · Physics 2025-12-23 Swati S. Priyadarsini , Karthik Gururangan , Jun Shen , Piotr Piecuch

The energy gap between the lowest-lying singlet and triplet states is an important quantity in chemical photocatalysis, with relevant applications ranging from triplet fusion in optical upconversion to the design of organic light-emitting…

Chemical Physics · Physics 2019-08-29 James Shee , Evan J. Arthur , Shiwei Zhang , David R. Reichman , Richard A. Friesner

Kane and Mele predicted that in presence of spin-orbit interaction graphene realizes the quantum spin Hall state. However, exceptionally weak intrinsic spin-orbit splitting in graphene ($\approx 10^{-5}$ eV) inhibits experimental…

Mesoscale and Nanoscale Physics · Physics 2013-06-18 Gabriel Autès , Oleg V. Yazyev

Spin qubits defined in carbon nanotube quantum dots are of considerable interest for encoding and manipulating quantum information because of the long electron spin coherence times expected. However, before carbon nanotubes can find…

Mesoscale and Nanoscale Physics · Physics 2010-04-27 S. J. Chorley , G. Giavaras , J. Wabnig , G. A. C. Jones , C. G. Smith , G. A. D. Briggs , M. R. Buitelaar

We present an extension of density matrix based linear scaling electronic structure theory to incorporate spin degrees of freedom. When the spin multiplicity of the system can be predetermined, the generalization of the existing linear…

Materials Science · Physics 2007-05-23 H. J. Xiang , W. Z. Liang , Jinlong Yang , J. G. Hou , Qingshi Zhu

Central to the enigma of the cuprates is ubiquitous electronic inhomogeneity arising from a variety of electronic orders that coexist with superconductivity, the individual signatures of which have been impossible to disentangle despite…

Superconductivity · Physics 2023-11-02 Riju Banerjee , Emily L. Wang , Eric W. Hudson

Since the lattices of ABA-stacked graphene multilayers with an even number of layers, as well as that of monolayer graphene, satisfy spatial-inversion symmetry, their electronic bands must be spin degenerate in the presence of…

Mesoscale and Nanoscale Physics · Physics 2013-05-29 Edward McCann , Mikito Koshino

Intensive research has focused on harnessing the potential of graphene for electronic, optoelectronic, and spintronic devices by generating a bandgap at the Dirac point and enhancing the spin-orbit interaction in the graphene layer.…

Two magnetic impurities on the edge of a zigzag graphene nanoribbon strongly interact with each other via indirect coupling, which can be mediated by conducting carriers. By means of Quantum Monte Carlo (QMC) simulations, we find that the…

Strongly Correlated Electrons · Physics 2015-03-09 F. M. Hu , Liangzhi Kou , Thomas Frauenheim

We analyze and give estimates for the long-distance coupling via floating metallic gates between different types of spin qubits in quantum dots made of different commonly used materials. In particular, we consider the hybrid, the…

Mesoscale and Nanoscale Physics · Physics 2017-06-28 Marcel Serina , Christoph Kloeffel , Daniel Loss

Tailor-made graphene nanostructures can exhibit symmetry-protected topological boundary states that host localized spin-$1/2$ moments. However, one frequently observes charge transfer on coinage metal substrates, which results in spinless…

We report a first-principles study on electronic structures of the deformed armchair graphene nanoribbons (AGNRs). The variation of the energy gap of AGNRs as a function of uniaxial strain displays a zigzag pattern, which indicates that the…

Materials Science · Physics 2007-05-23 Lian Sun , Qunxiang Li , Hao Ren , Q. W. Shi , Jinlong Yang , J. G. Hou
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