Orbital Geometry‐Governed Response of Pressure‐Tunable Quantum Defects in hBN
Defects in hBN act as ultrasensitive quantum manometers when the energy of the intradefect optical transitions is modified by lattice compression. The orbital geometry of the electron wave functions governs how electron hopping and Coulomb interactions react uniquely to the reduction of the van der Waals gap and in‐plane compression, leading to robust ...
Magdalena Grzeszczyk +6 more
wiley +1 more source
Hubbard Model Calculations for Zinc Oxide Semiconductor
To investigate the effects of Hubbard on-site Coulombic correction on the structural and electronical characteristics of wurtzite zinc oxide, first-principles calculations using density functional theory (DFT) were carried out. Because of the changes in
Aqeel Ali
doaj +1 more source
Phase diagram of the frustrated Hubbard model
The Mott-Hubbard metal-insulator transition in the paramagnetic phase of the one-band Hubbard model has long been used to describe similar features in real materials like V$_2$O$_3$.
Bulla, R. +3 more
core +1 more source
Strain Engineering of Magnetoresistance and Magnetic Anisotropy in CrSBr
Biaxial compressive strain significantly enhances magnetoresistance and critical saturation fields in thin flakes of the 2D magnet CrSBr, along all three crystallographic axes. First‐principles calculations link these effects to strain‐induced increases in exchange interactions and magnetic anisotropy.
Eudomar Henríquez‐Guerra +19 more
wiley +1 more source
Nature of the Peierls- to Mott-insulator transition in 1D
In order to clarify the physics of the crossover from a Peierls band insulator to a correlated Mott-Hubbard insulator, we analyze ground-state and spectral properties of the one-dimensional half-filled Holstein-Hubbard model using quasi-exact numerical ...
Fehske, H. +3 more
core +1 more source
Spin and Charge Control of Topological End States in Chiral Graphene Nanoribbons on a 2D Ferromagnet
Chiral graphene nanoribbons on a ferromagnetic gadolinium‐gold surface alloy display tunable spin and charge states at their termini. Atomic work function variations and exchange fields enabe transitions between singlet, doublet, and triplet configurations.
Leonard Edens +8 more
wiley +1 more source
Fault-Tolerant Quantum Simulation of Generalized Hubbard Models
Quantum simulations of strongly interacting fermionic systems, such as those described by the Hubbard model, are promising candidates for useful early fault-tolerant quantum computing applications.
Andreas Juul Bay-Smidt +5 more
doaj +1 more source
Phase diagrams of the Bose-Fermi-Hubbard model: Hubbard operator approach
The phase transitions in the Bose-Fermi-Hubbard model are investigated. The boson Green's function is calculated in the random phase approximation (RPA) and the formalism of the Hubbard operators is used.
I.V. Stasyuk +2 more
doaj +1 more source
Evaluation of the two-particle propagator for Hubbard model with the help of Hubbard-I approximation
The Hubbard-I approximation is generalized to allow for direct evaluation of the equal-time anomalous two-electron propagator for Hubbard model on two-dimensional square lattice.
A.L. Rakhmanov, A.V. Rozhkov, Aimi
core +1 more source
Opportunities of Semiconducting Oxide Nanostructures as Advanced Luminescent Materials in Photonics
The review discusses the challenges of wide and ultrawide bandgap semiconducting oxides as a suitable material platform for photonics. They offer great versatility in terms of tuning microstructure, native defects, doping, anisotropy, and micro‐ and nano‐structuring. The review focuses on their light emission, light‐confinement in optical cavities, and
Ana Cremades +7 more
wiley +1 more source

