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- Currently displaying 61 - 80 of 27920 publications
Extension, development, and evaluation of the representation of the OH-initiated dimethyl sulfide (DMS) oxidation mechanism in the Master Chemical Mechanism (MCM) v3.3.1 framework
– Atmospheric Chemistry and Physics
(2024)
24,
3329
(doi: 10.5194/acp-24-3329-2024)
Extension, Development and Evaluation of the representation of the OH-initiated DMS oxidation mechanism in the MCM v3.3.1 framework
– Atmospheric Chemistry and Physics (ACP)
(2024)
(doi: 10.5194/acp-24-3329-2024)
Folded Spectrum VQE: A Quantum Computing Method for the Calculation of Molecular Excited States.
– Journal of chemical theory and computation
(2024)
20,
2491
(doi: 10.1021/acs.jctc.3c01378)
Multicomponent Synthesis of α-Branched Amines via a Zinc-Mediated Carbonyl Alkylative Amination Reaction.
– Journal of the American Chemical Society
(2024)
146,
9045
(doi: 10.1021/jacs.3c14037)
Can GW handle multireference systems?
– The Journal of Chemical Physics
(2024)
160,
114101
(doi: 10.1063/5.0196561)
Can $GW$ Handle Multireference Systems?
– Journal of Chemical Physics
(2024)
(doi: 10.48550/arxiv.2401.03745)
Palladium (II)‐Catalyzed C−H Activation with Bifunctional Ligands: From Curiosity to Industrialization
– Angewandte Chemie (International ed. in English)
(2024)
63,
e202400509
(doi: 10.1002/anie.202400509)
Suppressing cis/trans ‘Ring‐flipping’ in Organoaluminium(III)‐2‐pyridyl Dimers – Design Strategies Towards Lewis Acid Catalysts for Alkene Oligomerisation
– Chemistry – A European Journal
(2024)
e202303872
(doi: 10.1002/chem.202303872)
Suppression of Dexter transfer by covalent encapsulation for efficient matrix-free narrowband deep blue hyperfluorescent OLEDs.
– Nature materials
(2024)
23,
1
(doi: 10.1038/s41563-024-01812-4)
Insights into charge transfer dynamics of Li batteries through temperature-dependent electrochemical impedance spectroscopy (EIS) utilizing symmetric cell configuration
– Electrochimica Acta
(2024)
485,
144080
Electrostatic [FeFe]-hydrogenase-carbon nitride assemblies for efficient solar hydrogen production
– Chemical Science
(2024)
15,
6088
(doi: 10.1039/d4sc00640b)
Translational eigenstates of He@C60 from four-dimensional ab initio potential energy surfaces interpolated using Gaussian process regression
– J Chem Phys
(2024)
160,
104303
(doi: 10.1063/5.0197903)
Analysis of UKESM1-StratTrop CCMI2022 experiments with a focus on ozone trends
(2024)
Estimating the causal effect of temperature on ozone air pollution
(2024)
Uncovering the effect of fires in Jambi, Riau, and South Sumatra on PM2.5 concentration levels in Greater Kuala Lumpur during September 2019 transboundary haze pollution
(2024)
(doi: 10.5194/egusphere-egu24-8954)
Uncertainties in tropospheric ozone changes due to natural precursor emissions
(2024)
(doi: 10.5194/egusphere-egu24-4434)
Historical sulfate aerosol formation in earth system model with interactive-chemistry: interplay between emission location, seasonality, meteorology and available oxidants
(2024)
(doi: 10.5194/egusphere-egu24-1018)
Rationale for the extrapolation procedure in selected configuration interaction.
– Journal of Chemical Physics
(2024)
160,
104102
(doi: 10.1063/5.0192458)
Ligand Directed Self-Assembly of Organic- Semiconductor/Quantum-Dot Blend Films Enables Efficient Triplet Exciton-Photon Conversion
– J Am Chem Soc
(2024)
146,
7763
(doi: 10.1021/jacs.4c00125)