Recent progress in the phase-transition mechanism and modulation of vanadium dioxide materials

Z Shao, X Cao, H Luo, P Jin - NPG Asia Materials, 2018 - nature.com
Metal-to-insulator transition (MIT) behaviors accompanied by a rapid reversible phase
transition in vanadium dioxide (VO2) have gained substantial attention for investigations into …

Recent progress in VO2 smart coatings: Strategies to improve the thermochromic properties

S Wang, M Liu, L Kong, Y Long, X Jiang… - Progress in Materials …, 2016 - Elsevier
Vanadium dioxide (VO 2) has attracted a great interest for smart coating applications
because of its promising thermochromic properties. Thermochromic performance of VO 2 is …

QMCPACK: an open source ab initio quantum Monte Carlo package for the electronic structure of atoms, molecules and solids

J Kim, AD Baczewski, TD Beaudet… - Journal of Physics …, 2018 - iopscience.iop.org
QMCPACK is an open source quantum Monte Carlo package for ab initio electronic
structure calculations. It supports calculations of metallic and insulating solids, molecules …

Isostructural metal-insulator transition in VO2

D Lee, B Chung, Y Shi, GY Kim, N Campbell, F Xue… - Science, 2018 - science.org
The metal-insulator transition in correlated materials is usually coupled to a symmetry-
lowering structural phase transition. This coupling not only complicates the understanding of …

Importance of the kinetic energy density for band gap calculations in solids with density functional theory

F Tran, P Blaha - The Journal of Physical Chemistry A, 2017 - ACS Publications
Recently, exchange-correlation potentials in density functional theory were developed with
the goal of providing improved band gaps in solids. Among them, the semilocal potentials …

Instantaneous Band Gap Collapse in Photoexcited Monoclinic due to Photocarrier Doping

D Wegkamp, M Herzog, L Xian, M Gatti, P Cudazzo… - Physical review …, 2014 - APS
Using femtosecond time-resolved photoelectron spectroscopy we demonstrate that
photoexcitation transforms monoclinic VO 2 quasi-instantaneously into a metal. Thereby, we …

Inherent stochasticity during insulator–metal transition in VO2

S Cheng, MH Lee, R Tran, Y Shi, X Li… - Proceedings of the …, 2021 - National Acad Sciences
Vanadium dioxide (VO2), which exhibits a near-room-temperature insulator–metal transition,
has great potential in applications of neuromorphic computing devices. Although its volatile …

[HTML][HTML] Tracking the optical constants of porous vanadium dioxide thin films during metal–insulator transition: Influence of processing conditions on their application in …

J Outón, E Blanco, M Domínguez, H Bakkali… - Applied Surface …, 2022 - Elsevier
Vanadium dioxide (VO 2) is widely recognized as a thermochromic material with great
potential for application in smart glazing for energy-efficient buildings. The monoclinic (M1) …

Unraveling the Mott-Peierls intrigue in vanadium dioxide

F Grandi, A Amaricci, M Fabrizio - Physical Review Research, 2020 - APS
Vanadium dioxide is one of the most studied strongly correlated materials. Nonetheless, the
intertwining between electronic correlation and lattice effects has precluded a …

[HTML][HTML] Semilocal exchange-correlation potentials for solid-state calculations: Current status and future directions

F Tran, J Doumont, L Kalantari, AW Huran… - Journal of Applied …, 2019 - pubs.aip.org
Kohn-Sham (KS) density functional theory (DFT) is a very efficient method for calculating
various properties of solids as, for instance, the total energy, the electron density, or the …