Theoretical advances in polariton chemistry and molecular cavity quantum electrodynamics

A Mandal, MAD Taylor, BM Weight… - Chemical …, 2023 - ACS Publications
When molecules are coupled to an optical cavity, new light–matter hybrid states, so-called
polaritons, are formed due to quantum light–matter interactions. With the experimental …

Pressure induced nanoparticle phase behavior, property, and applications

F Bai, K Bian, X Huang, Z Wang, H Fan - Chemical reviews, 2019 - ACS Publications
Nanoparticle (NP) high pressure behavior has been extensively studied over the years. In
this review, we summarize recent progress on the studies of pressure induced NP phase …

[HTML][HTML] The ONETEP linear-scaling density functional theory program

JCA Prentice, J Aarons, JC Womack… - The Journal of …, 2020 - pubs.aip.org
We present an overview of the onetep program for linear-scaling density functional theory
(DFT) calculations with large basis set (plane-wave) accuracy on parallel computers. The …

Size-Dependent Response of CdSe Quantum Dots to Hydrostatic Pressure

Z Chen, JC Beimborn, N Kirkwood… - The Journal of …, 2023 - ACS Publications
The size-dependent pressure response of oleate-stabilized CdSe quantum dots (QDs) in
paraffin is investigated using diamond anvil cell experiments and density functional theory …

Density functional theory calculations of large systems: Interplay between fragments, observables, and computational complexity

W Dawson, A Degomme, M Stella… - Wiley …, 2022 - Wiley Online Library
In the past decade, developments of computational technology around density functional
theory (DFT) calculations have considerably increased the system sizes which can be …

Synthesis and characterization of metal phthalocyanine bearing carboxylic acid anchoring groups for nanoparticle dispersion and their application to color filters

JW Namgoong, HM Kim, SH Kim, SB Yuk, J Choi… - Dyes and …, 2021 - Elsevier
The color filter is an integral part of the white-OLED display, LCD, and CMOS image sensor.
This study aimed to improve the color property and thermal stability of a dye-based color …

Piezochromic luminescence in all-inorganic core–shell InP/ZnS nanocrystals via pressure-modulated strain engineering

H Liu, X Zhao, X Yang, Y Wang, M Wu, J Jiang… - Nanoscale …, 2020 - pubs.rsc.org
Piezochromic materials alter their photoluminescent (PL) colors in response to the action of
external force. Such materials have attracted much attention owing to their promising …

Tailoring optical properties of luminescent semiconducting nanocrystals through hydrostatic, anisotropic static, and dynamic pressures

GM Biesold, S Liang, B Brettmann… - Angewandte Chemie …, 2021 - Wiley Online Library
Luminescent semiconductor nanocrystals are a fascinating class of materials because of
their size‐dependent emissions. Numerous past studies have demonstrated that …

X-ray total scattering study of magic-size clusters and quantum dots of cadmium sulphide

L Tan, AJ Misquitta, A Sapelkin, L Fang, RM Wilson… - Nanoscale, 2019 - pubs.rsc.org
Four types of magic-size CdS clusters and three different CdS quantum dots have been
studied using the technique of X-ray total scattering and pair distribution function analysis …

Piezotronic effect on the luminescence of quantum dots for micro/nano-newton force measurement

Y Zhang, J Nie, L Li - Nano Research, 2018 - Springer
The luminescence of semiconductor quantum dots (QDs) can be adjusted using the
piezotronic effect. An external mechanical force applied on the QD generates a piezoelectric …