Thermochromic energy efficient windows represent an important protocol technology for
advanced architectural windows with energy-saving capabilities through the intelligent …

Rapid development of the thermochromic glazing technique promises next-generation
architectural windows with energy-saving characteristics by intelligently regulating indoor …

The aim of this review article is to assess the descriptive capabilities of the Hubbard‐rooted
LDA+ U method and to clarify the conditions under which it can be expected to be most …

Orbital occupancy control in correlated oxides allows the realization of new electronic
phases and collective state switching under external stimuli. The resultant structural and …

The complex interplay among several active degrees of freedom (charge, lattice, orbital, and
spin) is thought to determine the electronic properties of many oxides. We report on …

Vanadium dioxide (VO 2) is a paradigmatic example of a strongly correlated system that
undergoes a metal-insulator transition at a structural phase transition. To date, this transition …

Recent experiments on vanadium-based nonmagnetic kagomé metals AV 3 Sb 5 (A= K, Rb,
Cs) revealed evidence for possible spontaneous time-reversal symmetry (TRS) breaking in …

In this paper, we propose an energy functional at the level of DFT+ U+ V that allows us to
compute self-consistently the values of the onsite interaction, Hubbard U and Hund J, as …

Vanadium dioxide is one of the most studied strongly correlated materials. Nonetheless, the
intertwining between electronic correlation and lattice effects has precluded a …

To explore the driving mechanisms of the metal-insulator transition (MIT) and the structural
transition in VO 2, we have investigated phonon dispersions of rutile VO 2 (R-VO 2) in the …