Results 41 to 50 of about 101,301 (257)
Nuclear magnetic resonance (NMR) and liquid chromatography-mass spectrometry (LCMS) are frequently used as technological platforms for metabolomics applications.
de Vos, C.H. +5 more
core +1 more source
Tensor representation of quadrupole expansion for softened potentials in N-body simulations
A tensor representation for quadrupole expansion is proposed as a recipe for n-body simulations of collisionless stellar systems that do not perform the direct summation method, as is the case of TREECODE.
Marinho, Eraldo Pereira [UNESP]
core +1 more source
The energetic offset between the donor and the acceptor components in organic photoactive layers is central to the tradeoff between photovoltage and photocurrent losses. This Perspective covers the most important issues surrounding this topic in non‐fullerene acceptor blends, from the difficulty of accurately determining state energies and driving ...
Dieter Neher, Manasi Pranav
wiley +1 more source
Photoassociation of a cold-atom–molecule pair: Long-range quadrupole-quadrupole interactions
The general formalism of the multipolar expansion of electrostatic interactions is applied to the calculation of the potential energy between an excited atom (without fine structure) and a ground-state diatomic molecule at large mutual separations.
Lepers, M. +6 more
core +1 more source
Enhancement of specular behavior in atom mirrors with quadrupole-active transitions
Modern studies have confirmed the possibility of making atomic mirrors using quadrupole-active atomic transition evanescent waves. The reflection process has been shown to be enhanced to approach specular behavior in several ways.
S. Al-Awfi
core +1 more source
ABSTRACT Accurately knowing the frontier orbital energies of the structurally disordered small‐molecule organic semiconductors that are used in optoelectronic devices such as organic light‐emitting diodes is required to rationally improve their performance. Here, we show that these energies can be deduced with a large accuracy from the peak energies of
Christian B. McDonald +7 more
wiley +1 more source
Derivation of the radial dependence of the quadrupole force from a Woods-Saxon potential
Abstract For use in calculation of collective quadrupole phenomena we construct a modified quadrupole force, whose radial dependence is related to that of a Woods-Saxon well. Matrix elements and self-consistent interaction strengths are compared to those of the usual quadrupole force, which is based on a harmonic oscillator potential.
Kumar, K., Sorensen, B.
openaire +2 more sources
Quadrupole topological phases in the zero-dimensional optical cavity
The quadrupole topological insulator, which supports robust corner states, has been recently demonstrated in two-dimensional (2D) spatial lattices. Here, we design the first photonic quadrupole topological insulator in fully synthetic spaces with the ...
Xiangdong Zhang, Weixuan Zhang
core +1 more source
Second‐Harmonic Hyper‐Mie Optical Activity Enables Closed‐Loop Chiral Photochemistry
Nonlinear chiral photochemistry is demonstrated in CdTe/CdO nanohelices, where circularly polarized infrared light both drives and tracks photo‐oxidation via second‐harmonic scattering. This closed‐loop process reveals real‐time structural evolution, including shell fracturing and core exposure, accompanied by a transition from hyper‐Mie to hyper ...
Hoyeon Choi +6 more
wiley +1 more source
We introduce a computational workflow that combines quantum chemical calculations and machine learning techniques to predict the catalytic performance of a wide range of catalysts in the nitrogen reduction reaction (NRR). The analysis of the trained models provides insights into the complex structure–activity relationship in experimental catalytic ...
Leonardo Di Ciano +5 more
wiley +1 more source

