The radical-pair mechanism of magnetoreception

PJ Hore, H Mouritsen - Annual review of biophysics, 2016 - annualreviews.org
Although it has been known for almost half a century that migratory birds can detect the
direction of the Earth's magnetic field, the primary sensory mechanism behind this …

Advanced polyimide materials: Syntheses, physical properties and applications

DJ Liaw, KL Wang, YC Huang, KR Lee, JY Lai… - Progress in Polymer …, 2012 - Elsevier
Polyimides rank among the most heat-resistant polymers and are widely used in high
temperature plastics, adhesives, dielectrics, photoresists, nonlinear optical materials …

Atomic-scale engineering of indium oxide promotion by palladium for methanol production via CO2 hydrogenation

MS Frei, C Mondelli, R García-Muelas, KS Kley… - Nature …, 2019 - nature.com
Metal promotion is broadly applied to enhance the performance of heterogeneous catalysts
to fulfill industrial requirements. Still, generating and quantifying the effect of the promoter …

Multifunctional molecular modulators for perovskite solar cells with over 20% efficiency and high operational stability

D Bi, X Li, JV Milić, DJ Kubicki, N Pellet, J Luo… - Nature …, 2018 - nature.com
Perovskite solar cells present one of the most prominent photovoltaic technologies, yet their
stability, scalability, and engineering at the molecular level remain challenging. We …

The structure of the necrosome RIPK1-RIPK3 core, a human hetero-amyloid signaling complex

M Mompeán, W Li, J Li, S Laage, AB Siemer, G Bozkurt… - Cell, 2018 - cell.com
The RIPK1-RIPK3 necrosome is an amyloid signaling complex that initiates TNF-induced
necroptosis, serving in human immune defense, cancer, and neurodegenerative diseases …

Quest for a universal density functional: the accuracy of density functionals across a broad spectrum of databases in chemistry and physics

R Peverati, DG Truhlar - Philosophical Transactions of …, 2014 - royalsocietypublishing.org
Kohn–Sham density functional theory is in principle an exact formulation of quantum
mechanical electronic structure theory, but in practice we have to rely on approximate …

The electrostatic potential: an overview

JS Murray, P Politzer - Wiley Interdisciplinary Reviews …, 2011 - Wiley Online Library
The electrostatic potential V (r) that is created by a system of nuclei and electrons is
formulated directly from Coulomb's law and is a physical observable, which can be …

Molecular modelling framework of metal-organic clusters for conserving surfaces: Langmuir sorption through the TD-DFT/ONIOM approach

F Mollaamin, M Monajjemi - Molecular Simulation, 2023 - Taylor & Francis
The Langmuir adsorption model of some organic inhibitors containing benzotriazole (BTA),
8-hydroxyquinoline (8-HQ), and 2-mercaptobenzothiazole (2-MBT) onto the Al-X (X= Mg …

Hybridisation of perovskite nanocrystals with organic molecules for highly efficient liquid scintillators

S Cho, S Kim, J Kim, Y Jo, I Ryu, S Hong… - Light: Science & …, 2020 - nature.com
Compared with solid scintillators, liquid scintillators have limited capability in dosimetry and
radiography due to their relatively low light yields. Here, we report a new generation of …

Towards the solution of the many-electron problem in real materials: Equation of state of the hydrogen chain with state-of-the-art many-body methods

M Motta, DM Ceperley, GKL Chan, JA Gomez, E Gull… - Physical Review X, 2017 - APS
We present numerical results for the equation of state of an infinite chain of hydrogen atoms.
A variety of modern many-body methods are employed, with exhaustive cross-checks and …