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Hybrid organic-inorganic perovskites are famous for the diversity of their chemical compositions, phases and phase transitions, and associated physical properties. We use a combination of experimental and computational techniques to reveal…

It is demonstrated for the first time that the strong coupling between spin moments of copper ions and oxygen holes, which arises upon hybridazation mixing of two hole subsystems in the Emery model, not only affects the formation of spin…

Superconductivity · Physics 2023-07-19 V. V. Val'kov , D. M. Dzebisashvili , A. F. Barabanov

A spin Hamiltonian, which characterizes interatomic interactions between spin moments, is highly valuable in predicting and comprehending the magnetic properties of materials. A deeper understanding of the microscopic origin of magnetic…

We present a theoretical study of the impact of an electric field combined with a magnetic field on the rotational dynamics of open shell diatomic molecules. Within the rigid rotor approximation, we solve the time-independent Schr\"odinger…

Chemical Physics · Physics 2015-06-12 Martin Gärttner , Juan J. Omiste , Peter Schmelcher , Rosario González-Férez

Spin-orbit coupling is a single-particle phenomenon known to generate topological order, and electron-electron interactions cause ordered many-body phases to exist. The rich interplay of these two mechanisms is present in a broad range of…

Mesoscale and Nanoscale Physics · Physics 2017-12-20 Weizhe Edward Liu , Stefano Chesi , David Webb , U. Zuelicke , R. Winkler , Robert Joynt , Dimitrie Culcer

We clarify the macroscopic symmetry and microscopic model-parameter conditions for emergence of spin-split electronic band structure in collinear antiferromagnets without atomic spin-orbit coupling. By using the microscopic multipole…

Strongly Correlated Electrons · Physics 2019-11-12 Satoru Hayami , Yuki Yanagi , Hiroaki Kusunose

We investigate the existence of linear magnetism in the metal organic framework materials MOF-74-Fe, MOF-74-Co, and MOF-74-Ni, using first-principles density functional theory. MOF-74 displays regular quasi-linear chains of open-shell…

Materials Science · Physics 2013-03-08 Pieremanuele Canepa , Yves J. Chabal , T. Thonhauser

All-trans-retinoic acid (ReA), a closed-shell organic molecule comprising only C, H, and O atoms, is investigated on a Au(111) substrate using scanning tunneling microscopy and spectroscopy. In dense arrays single ReA molecules are switched…

Artificial spin-ice systems, consisting of arrays of interacting ferromagnetic nanoelements, offer a versatile platform for reconfigurable magnonics with potential in GHz logic and neuromorphic computing. However, weak dipolar coupling…

Mesoscale and Nanoscale Physics · Physics 2024-11-25 Syamlal Sankaran Kunnath , Mateusz Zelent , Mathieu Moalic , Maciej Krawczyk

We demonstrate the occurrence of compensated spin configurations in Fe clusters and monolayers on Ru(0001) and Rh(111) by a combination of X-ray magnetic circular dichroism experiments and first-principles calculations. Our results reveal…

Materials Science · Physics 2014-03-18 V. Sessi , F. Otte , S. Krotzky , C. Tieg , M. Wasniowska , P. Ferriani , S. Heinze , J. Honolka , K. Kern

Density functional calculations are performed to study the magnetic order of the severely distorted square planar cupric oxide (CuO) and local spin disorder in it in the presence of the transition metal impurities M (= Cr, Mn, Fe, Co and…

Strongly Correlated Electrons · Physics 2017-04-05 B. G. Ganga , P. N. Santhosh , B. R. K. Nanda

Molecular nanomagnets show clear signatures of coherent behavior and have a wide variety of effective low-energy spin Hamiltonians suitable for encoding qubits and implementing spin-based quantum information processing. At the nanoscale,…

Mesoscale and Nanoscale Physics · Physics 2013-05-29 Mircea Trif , Filippo Troiani , Dimitrije Stepanenko , Daniel Loss

We apply the atom-atom potentials to molecular crystals of iron (II) complexes with bulky organic ligands. The crystals under study are formed by low-spin or high-spin molecules of Fe(phen)$_{2}$(NCS)$_{2}$ (phen = 1,10-phenanthroline),…

We consider a model of the double perovskite Ba2FeReO6, a room temperature ferrimagnet with correlated and spin-orbit coupled Re t2g electrons moving in the background of Fe moments stabilized by Hund's coupling. We show that for such 3d/5d…

Strongly Correlated Electrons · Physics 2015-06-16 A. M. Cook , A. Paramekanti

Due to the large perpendicular magnetic anisotropy originating from spin-orbit coupling, magnetoelastic coupling is generally reported in easy-plane magnets with rectangular lattice where the easy magnetization is coupled with the lattice…

Materials Science · Physics 2024-11-08 Yu Liao , Yueqiao Qu , Zuo Li , Yu Chen , Liang Liu , Jun-Zhong Wang , Gang Yao

It is a well established notion that animals can detect the Earth's magnetic field, while the biophysical origin of such magnetoreception is still elusive. Recently, a magnetic receptor Drosophila CG8198 (MagR) with a rod-like protein…

Mesoscale and Nanoscale Physics · Physics 2018-04-12 Yunshan Cao , Peng Yan

Molecule oxygen resembles 3d and 4f metals in exhibiting long-range spin ordering and electron strong correlated behaviors in compounds. The ferromagnetic spin ordering and half-metallicity, however, are quite elusive and have not been well…

Materials Science · Physics 2020-07-14 Jun Deng , Jiangang Guo , Xiaolong Chen

Both Ba$_4$Mn$_3$O$_{10}$ and Sr$_4$Mn$_3$O$_{10}$ crystallize in an orthorhombic crystal structure consisting of corrugated layers containing Mn$_3$O$_{12}$ polydedra. The thermal variation of magnetic susceptibility of the compositions…

Strongly Correlated Electrons · Physics 2015-06-23 J. Sannigrahi , S. Chattopadhyay , A. Bhattacharyya , S. Giri , S. Majumdar , D. Venkateshwarlu , V. Ganesan

We have fabricated hybrid magnetic complexes from V atoms and tetracyanoethylene (TCNE) ligands via atomic manipulation with a cryogenic scanning tunneling microscope. Using tunneling spectroscopy we observe spin-polarized molecular…

Two-dimensional metallic altermagnets are rare, and no correlated 2D material has been established to host large nonrelativistic spin splitting. Here we show that spontaneous orbital order, driven by electronic correlations and Fermi…

Mesoscale and Nanoscale Physics · Physics 2026-03-27 Nirmalya Jana , Atasi Chakraborty , Anamitra Mukherjee , Amit Agarwal