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- Currently displaying 1981 - 2000 of 30147 publications
Computational Prediction of an Antimony-based n-type Transparent Conducting Oxide: F-doped Sb2O5
(2023)
(doi: 10.26434/chemrxiv-2023-8l7pb)
Effect of Cerium Oxide Nanoparticle Morphology on the Performance and Durability of Hydrogen/Air Fuel Cell Electrodes
ECS Meeting Abstracts
(2023)
MA2023-02
2014
Oxygen Hole Formation Controls Stability in LiNiO2 Cathodes: DFT Studies of Oxygen Loss and Singlet Oxygen Formation in Li-Ion Batteries
ECS Meeting Abstracts
(2023)
MA2023-02
162
(doi: 10.1149/ma2023-022162mtgabs)
Solvent-Driven Degradation of Ni-Rich Cathodes Probed by Operando Gas Analysis
ECS Meeting Abstracts
(2023)
MA2023-02
348
(doi: 10.1149/ma2023-022348mtgabs)
Monoclonal antibodies targeting cytotoxic α-synuclein oligomers: molecular properties and diagnostic potential
(2023)
(doi: 10.21203/rs.3.rs-3778118/v1)
Towards High-Capacity Recovery Aprotic Li-O2 Batteries
ECS Meeting Abstracts
(2023)
MA2023-02
109
(doi: 10.1149/ma2023-021109mtgabs)
Thermodynamic Stability of LixNiO2 and Polyvinylidene Difluoride Materials for Lithium+ Ion Batteries
ECS Meeting Abstracts
(2023)
MA2023-02
275
(doi: 10.1149/ma2023-022275mtgabs)
(Invited) Ionic Transport and Structure of Battery Electrolytes, Electrodes and Interfaces: New NMR, Diffraction and Optical Microscopy Approaches
ECS Meeting Abstracts
(2023)
MA2023-02
2423
In-situ Studies of Aqueous Organic Redox Flow Batteries
ECS Meeting Abstracts
(2023)
MA2023-02
3059
Operando 17o NMR Studies of Degradation in Li-Oxygen Batteries
ECS Meeting Abstracts
(2023)
MA2023-02
3404
(doi: 10.1149/ma2023-0283404mtgabs)
Understanding the Reaction Mechanism and Kinetics of Mediated Li-O2 Batteries Using Flow Set-Ups and Cyclic Voltammetry
ECS Meeting Abstracts
(2023)
MA2023-02
3401
(doi: 10.1149/ma2023-0283401mtgabs)
Rafting of Growing Antarctic Sea Ice Enhances In‐Ice Biogeochemical Activity in Winter
Journal of Geophysical Research - Oceans
(2023)
128
e2023JC019925
(doi: 10.1029/2023jc019925)
Applying atomistic neural networks to bias conformer ensembles towards bioactive-like conformations.
Journal of cheminformatics
(2023)
15
124
(doi: 10.1186/s13321-023-00794-w)
Implementation and evaluation of updated photolysis rates in the EMEP MSC-W chemistry-transport model using Cloud-J v7.3e
Geoscientific Model Development
(2023)
16
7433
(doi: 10.5194/gmd-16-7433-2023)
Impacts of supercapacitor electrode structure on electrochemical CO2 capture
(2023)
(doi: 10.26434/chemrxiv-2023-nj817)
Structural Disorder Determines Capacitance in Nanoporous Carbons
(2023)
(doi: 10.26434/chemrxiv-2023-bd24m)
Diamond-Like Carbon: A Surface for Extreme, High-Wear Environments
Langmuir: the ACS journal of surfaces and colloids
(2023)
40
52
(doi: 10.1021/acs.langmuir.3c01438)
Bayesian Optimization in the Latent Space of a Variational Autoencoder for the Generation of Selective FLT3 Inhibitors.
Journal of chemical theory and computation
(2023)
20
469
(doi: 10.1021/acs.jctc.3c01224)
RASP: Optimal single fluorescent puncta detection in complex cellular backgrounds
(2023)
(doi: 10.1101/2023.12.18.572148)
Transferable Machine Learning Interatomic Potential for Bond Dissociation Energy Prediction of Drug-like Molecules
Journal of chemical theory and computation
(2023)
20
164
(doi: 10.1021/acs.jctc.3c00710)