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Magnetic properties of a tetrahedral "Ni_4" molecule are discussed in terms of the Heisenberg model, with magnetic anisotropy terms included, and on the basis of first-principle calculations within the density functional theory. It is shown…

Materials Science · Physics 2007-05-23 A. V. Postnikov , M. Brueger , J. Schnack

We study the entanglement properties of a molecular three-qubit system described by the Heisenberg spin Hamiltonian with anisotropic exchange interactions and including an external magnetic field. The system exhibits first order quantum…

Quantum Physics · Physics 2015-05-14 Amit Kumar Pal , Indrani Bose

We investigate key quantum characteristics of the mixed spin-(1/2,1,1/2) Heisenberg trimer under the influence of an external magnetic field. Specifically, we analyze the distributions of bipartite and tripartite entanglement quantified…

Ground-state phase diagrams and magnetization curves of a spin-1 Heisenberg diamond cluster with two different coupling constants and uniaxial single-ion anisotropy are investigated in a presence of the external magnetic field with the help…

Strongly Correlated Electrons · Physics 2021-10-18 Katarina Karlova , Jozef Strecka , Masayuki Hagiwara

Recent magnetic susceptibility measurements for polycrystalline samples of binuclear nitrosyl iron complexes [Fe_2(C_3H_3N_2S)_2(NO)_4] (I) and [Fe_2(SC_3H_5N_2)_2(NO)_4] (II), suggest that quantum-mechanical entanglement of the spin…

Quantum Physics · Physics 2009-11-13 S. M. Aldoshin , E. B. Feldman , M. A. Yurishchev

The quantum dimer magnet, with antiferromagnetic intradimer and interdimer Heisenberg exchange between spin-1/2 moments, is known to host an up/down - down/up singlet ground state when the intradimer exchange is dominant. Rare-earth-based…

Strongly Correlated Electrons · Physics 2025-09-10 A. Brassington , Q. Ma , G. Duan , S. Calder , A. I. Kolesnikov , K. M. Taddei , G. Sala , E. S. Choi , H. Wang , W. Xie , B. A. Frandsen , N. Li , X. F. Sun , C. Liu , R. Yu , H. D. Zhou , A. A. Aczel

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…

Strongly Correlated Electrons · Physics 2009-11-10 R. Koch , O. Waldmann , P. Mueller , U. Reimann , R. W. Saalfrank

The quantum dimer magnet (QDM) is the canonical example of quantum magnetism. The QDM state consists of entangled nearest-neighbor spin dimers and often exhibits a field-induced triplon Bose-Einstein condensate (BEC) phase. We report on a…

Strongly Correlated Electrons · Physics 2019-07-11 Gavin Hester , H. S. Nair , T. Reeder , D. R. Yahne , T. N. DeLazzer , L. Berges , D. Ziat , J. R. Neilson , A. A. Aczel , G. Sala , J. A. Quilliam , K. A. Ross

We investigate the behaviors of thermal entanglement, quantum correlation beyond entanglement namely, measurement-induced nonlocality (MIN) and coherence in a nickel radical molecular magnet (Et3NH)[Ni(hfac)2L], whose spin-spin interactions…

Quantum Physics · Physics 2026-02-24 S. Bhuvaneswari , R. Muthuganesan , R. Radha

The single-molecule magnet $\mathrm{[Ni(hmp)(MeOH)Cl]_4}$ is studied using both density functional theory (DFT) and the DFT+U method, and the results are compared. By incorporating a Hubbard-U like term for both the nickel and oxygen atoms,…

Strongly Correlated Electrons · Physics 2008-04-30 Chao Cao , Stephen Hill , Hai-Ping Cheng

Entanglement, a defining feature of quantum mechanics, arises naturally from interactions between molecular systems. Yet the precise nature and quantification of entanglement in the products of molecular collisions and reactions remain…

Atomic Physics · Physics 2026-01-27 Adrien Devolder , Paul Brumer , Timur Tscherbul

We use density functional theory to study the structural, magnetic and electronic structure of the organo-metallic quantum magnet $\mathrm{NiCl_2-4SC(NH_2)_2}$ (DTN). Recent work has demonstrated the quasi-1D nature of the molecular crystal…

Mesoscale and Nanoscale Physics · Physics 2021-03-03 Maher Yazback , Jie-Xiang Yu , Shuanglong Liu , Long Zhang , Neil S. Sullivan , Hai-Ping Cheng

Entangled solid state systems have gained a great deal of attention due to their fruitful applications in modern quantum technologies. Herein, detection of entanglement content from experimental magnetic susceptibility and specific heat…

Strongly Correlated Electrons · Physics 2019-06-10 Tanmoy Chakraborty , Harkirat Singh , Chiranjib Mitra

A general geometrical structure of the entanglement entropy for spatial partition of a relativistic QFT system is established by using methods of the effective gravity action and the spectral geometry. A special attention is payed to the…

High Energy Physics - Theory · Physics 2008-11-26 Dmitri V. Fursaev

The magnetic behavior of the Ca3Co2O6 spin chain compound is characterized by a large Ising-like character of its ferromagnetic chains, set on triangular lattice, that are antiferromagnetically coupled. At low temperature, T < 7K, the 3D…

Strongly Correlated Electrons · Physics 2007-05-23 A. Maignan , V. Hardy , S. Hebert , M. Drillon , M. R. Lees , O. Petrenko , D. Mc K. Paul , D. Khomskii

The magnetic properties of a new family of molecular-based quasi-two dimension $S=1/2$ Heisenberg antiferromagnets are reported. Three compounds, ($Cu(pz)_2(ClO_4)_2$, $Cu(pz)_2(BF_4)_2$, and $[Cu(pz)_2(NO_3)](PF_6)$) contain similar planes…

In gravitational theories with boundaries, diffeomorphisms can become physical and acquire a non-vanishing Noether charge. Using the covariant phase space formalism, on shell of the gravitational constraints, the latter localizes on…

High Energy Physics - Theory · Physics 2025-08-11 Luca Ciambelli , Jerzy Kowalski-Glikman , Ludovic Varrin

The synthesis of molecular magnets has undergone rapid progress in recent years. Each of the identical molecular units can contain as few as two and up to several dozens of paramagnetic ions (spins). Although these materials appear as…

Strongly Correlated Electrons · Physics 2009-11-11 J. Schnack

The effect of uniaxial single-ion anisotropy on quantum entanglement is rigorously quantified using negativity in a mixed spin-($1$,$1/2$,$1$) Heisenberg trimer, accounting for different exchange coupling constants between identical and…

Quantum Physics · Physics 2025-09-03 Hana Vargová , Jozef Strečka

This article takes a broad view of the understanding of magnetic bistability and magnetic quantum tunneling in single-molecule magnets (SMMs), focusing on three families of relatively simple, low-nuclearity transition metal clusters: spin S…

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