Fingerprints of spin-orbital physics in cubic Mott insulators: Magnetic exchange interactions and optical spectral weights
The temperature dependence and anisotropy of optical spectral weights associated with
different multiplet transitions is determined by the spin and orbital correlations. To provide a …
different multiplet transitions is determined by the spin and orbital correlations. To provide a …
Variational pseudo-self-interaction-corrected density functional approach to the ab initio description of correlated solids and molecules
We present a variational pseudo self-interaction correction density functional approach
(VPSIC) to the ab initio theoretical description of correlated solids and molecules. The …
(VPSIC) to the ab initio theoretical description of correlated solids and molecules. The …
Importance of anisotropic Coulomb interaction in
In low-temperature antiferromagnetic LaMnO 3, strong and localized electronic interactions
among Mn 3 d electrons prevent a satisfactory description from standard local density and …
among Mn 3 d electrons prevent a satisfactory description from standard local density and …
Chemically inducing room temperature spin-crossover in double layered magnetic refrigerants Pr1. 4+ xSr1. 6-xMn2O7 (0.0≤ x≤ 0.5)
The height of total entropy (ST) for a magnetic refrigerant material is essentially concerned
with the magnetic and structural transitions. However, the participation of such transitions in …
with the magnetic and structural transitions. However, the participation of such transitions in …
Effects of strain on orbital ordering and magnetism at perovskite oxide interfaces:
We study how strain affects orbital ordering and magnetism at the interface between SrMnO
3 and LaMnO 3 from density-functional calculations and interpret the basic results in terms of …
3 and LaMnO 3 from density-functional calculations and interpret the basic results in terms of …
Electron Leakage and Double-Exchange Ferromagnetism at the Interface <?format ?>between a Metal and an Antiferromagnetic Insulator:
Density-functional electronic structure studies of a prototype interface between a
paramagnetic metal and an antiferromagnetic (AFM) insulator (CaRuO 3/CaMnO 3) reveal …
paramagnetic metal and an antiferromagnetic (AFM) insulator (CaRuO 3/CaMnO 3) reveal …
Vacancy-enhanced ferromagnetism in Fe-doped rutile
Based on a series of supercell density functional calculations of Fe-doped Ti O 2 both with
and without O vacancy (VO), we show that VO plays an important role in determining the …
and without O vacancy (VO), we show that VO plays an important role in determining the …
Electronic structure and anomalous Hall effect in the ferromagnetic superlattice
The electronic structure and the anomalous Hall effect (AHE) at the recently grown 3 d-5 d
superlattice structure (SrMnO 3) 1/(SrIrO 3) 1 are investigated theoretically using model and …
superlattice structure (SrMnO 3) 1/(SrIrO 3) 1 are investigated theoretically using model and …
Electronic and magnetic structure of the superlattices
We study the magnetic structure of the (LaMnO 3) 2 n/(SrMnO 3) n superlattices from density-
functional calculations. In agreement with the experiments, we find that the magnetism …
functional calculations. In agreement with the experiments, we find that the magnetism …
Preparation and performance of dual‐functional magnetic phase‐change microcapsules
F Li, Z Sun, S Jiao, Y Ma, Q Zhang… - Chemistry–An Asian …, 2021 - Wiley Online Library
The fabrication of desired anti‐magnetic materials for irradiation shielding remains a
challenge to date. In this work, a new type of dual‐functional magnetic shielding phase …
challenge to date. In this work, a new type of dual‐functional magnetic shielding phase …