Results 81 to 90 of about 66,179 (347)
Enhanced Hybrid Differential Evolution for Earth-Moon Low-Energy Transfer Trajectory Optimization
International Journal of Aerospace Engineering, 2018 It is known that the optimization of the Earth-Moon low-energy transfer trajectory is extremely sensitive with the initial condition chosen to search.
Yanyun Zhang +3 more
doaj +1 more source
Excited-state energy component analysis for molecules - Why the lowest excited state is not always the HOMO-LUMO transition [PDF]
, 2023 Patrick Kimber, Felix Plasser
openalex +1 more source
Advanced Functional Materials, EarlyView.We fabricated a biomimetic dendrimer‐modified thin‐film nanocomposite membrane with a coordination‐assisted ion‐selective interface. pH‐responsive polypeptide sites preferentially bind Mg2+ and promote Li+ permeation, as predicted by density functional theory calculations of metal‐ligand interactions.
Mehrasa Yassari +7 more
wiley +1 more source
Evaluating the Efficacy of Enzyme-Induced Carbonate Precipitation (EICP) for Aeolian Sand Fixation
BuildingsEnzyme-Induced Calcium Carbonate Precipitation (EICP) shows promise for desertification control. This study investigates the effects of solid-to-liquid ratio, calcium sources, Ca2+ concentration, temperature, enzyme-to-liquid ratio (ELR), and pH on the ...
Lina Xiao +7 more
doaj +1 more source
Untargeted Top-down Proteomics byLC-MS/MS on Lumos v1
, 2021 Bryon Drown +2 more
openalex +1 more source
Advanced Functional Materials, EarlyView.Solution‐processed OLEDs containing discotic liquid‐crystalline MR‐TADF emitters are reported. Supramolecular self‐assembly induces homeotropic columnar alignment, enforcing preferential horizontal orientation of the emitter transition dipole moment in spin‐coated films, which leads to an enhancement in the device light outcoupling efficiency while ...
Joydip De +6 more
wiley +1 more source
Thermally Activated Delayed Fluorescence in Phase‐Separated Nanostructures
Advanced Functional Materials, EarlyView.A supramolecular, phase‐separation driven strategy yields charge transfer (CT) complexes from alternating electron‐deficient pyromellitic diimide and electron‐rich 4,5‐dibromoveratrole. The resulting CT complexes self‐assemble into lamellar nanosheets with nanometer‐sized domains that exhibit thermally activated delayed fluorescence (TADF) at room ...
Bart W.L. van den Bersselaar +8 more
wiley +1 more source
, 2019 Citation: 'LUMO' in the IUPAC Compendium of Chemical Terminology, 3rd ed.; International Union of Pure and Applied Chemistry; 2006. Online version 3.0.1, 2019. 10.1351/goldbook.L03650 • License: The IUPAC Gold Book is licensed under Creative Commons Attribution-ShareAlike CC BY-SA 4.0 International for individual terms. Requests for commercial usage of
openaire +1 more source
International Journal of Chemical Technology, 2019 Growing the molecular mechanism of chemicals, thermochemical and biological interactions is considered as the ultimate goal of computational chemistry.
Ajoy Kumer +2 more
semanticscholar +1 more source
Beyond the Edge: Charge‐Transfer Excitons in Organic Donor‐Acceptor Cocrystals
Advanced Functional Materials, EarlyView.Complex excitonic landscapes in acene–perfluoroacene cocrystals are unveiled by polarization‐resolved optical spectroscopy and many‐body theory. This systematic study of a prototypical model system for weakly interacting donor–acceptor compounds challenges common views of charge‐transfer excitons, providing a refined conceptual framework for ...
Sebastian Anhäuser +6 more
wiley +1 more source