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- Currently displaying 241 - 260 of 27901 publications
Transferable Machine Learning Interatomic Potential for Bond Dissociation Energy Prediction of Drug-like Molecules
(2023)
Efficient Cu2O Photocathodes for Aqueous Photoelectrochemical CO2 Reduction to Formate and Syngas
– Journal of the American Chemical Society
(2023)
145,
27939
(doi: 10.1021/jacs.3c06146)
Development and application of chemical linking strategies for post-translational protein–protein conjugation
(2023)
(doi: 10.17863/CAM.108269)
Connecting Biological and Synthetic Approaches for Electrocatalytic CO2 Reduction
– Angewandte Chemie
(2023)
136,
e202310547
(doi: 10.1002/ange.202310547)
Connecting Biological and Synthetic Approaches for Electrocatalytic CO2 Reduction
– Angewandte Chemie - International Edition
(2023)
63,
e202310547
(doi: 10.1002/anie.202310547)
Effect of Ionic Association in the Catalytic Mechanism of Redox Mediators for Li-air Batteries: a Theoretical Framework
(2023)
(doi: 10.26434/chemrxiv-2023-17v6c)
Synergistic Degradation Mechanism in Single Crystal Ni-Rich NMC//Graphite Cells
– ACS Energy Letters
(2023)
8,
5025
An atomic surface site interaction point description of non-covalent interactions.
– Chem Sci
(2023)
15,
160
(doi: 10.1039/d3sc05690b)
Superstructure and Correlated Na+ Hopping in a Layered Mg-substituted Sodium Manganate Battery Cathode are driven by Local Electroneutrality
– Chemistry of Materials
(2023)
35,
10564
Understanding the patterns and health impact of indoor air pollutant exposures in Bradford, UK: a study protocol.
– BMJ Open
(2023)
13,
e081099
(doi: 10.1136/bmjopen-2023-081099)
Reversible Ultrafast Chiroptical Responses in Planar Plasmonic Nano‐Oligomer
– Advanced materials (Deerfield Beach, Fla.)
(2023)
36,
e2304657
(doi: 10.1002/adma.202304657)
Charge-Dependent Crossover in Aqueous Organic Redox Flow Batteries Revealed Using On-Line NMR Spectroscopy
(2023)
Exploiting Locality in Full Configuration Interaction Quantum Monte Carlo for Fast Excitation Generation.
– Journal of Chemical Theory and Computation
(2023)
19,
9118
(doi: 10.1021/acs.jctc.3c00546)
Short-term forecasting of ozone air pollution across Europe with transformers
– Environmental Data Science
(2023)
2,
e43
(doi: 10.1017/eds.2023.37)
Origin of dielectric polarization suppression in confined water from first principles
– Chemical science
(2023)
15,
516
(doi: 10.1039/d3sc04740g)
Disproportionate impacts of the COVID-19 pandemic on early career researchers and disabled researchers in volcanology
– Frontiers in Earth Science
(2023)
11,
1291975
(doi: 10.3389/feart.2023.1291975)
Inkjet Printed Photonic Cellulose Nanocrystal Patterns.
– Adv Mater
(2023)
36,
e2307563
(doi: 10.1002/adma.202307563)
On the global minimum of the classical potential energy for clusters
bound by many-body forces
(2023)