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Physical Chemistry Chemical Physics : PCCP
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April 23, 2021
Theoretical evidence of water serving as a promoter for lithium superoxide disproportionation in Li-O<sub>2</sub> batteries
Nannan Shan, Paul C Redfern, Anh T Ngo, et al.
ACS Nano
|
December 14, 2017
Manipulation of Origin of Life Molecules: Recognizing Single-Molecule Conformations in β-Carotene and Chlorophyll-a/β-Carotene Clusters
Anh T Ngo, Timur Skeini, Violeta Iancu, et al.
The Journal of Physical Chemistry. A
|
July 5, 2022
Improving the Accuracy of Composite Methods: A G4MP2 Method with G4-like Accuracy and Implications for Machine Learning
Naveen K Dandu, Rajeev S Assary, Paul C Redfern, et al.
The Journal of Physical Chemistry. A
|
June 17, 2020
Quantum-Chemically Informed Machine Learning: Prediction of Energies of Organic Molecules with 10 to 14 Non-hydrogen Atoms
Naveen Dandu, Logan Ward, Rajeev S Assary, et al.
The Journal of Chemical Physics
|
December 17, 2015
An atomistically informed mesoscale model for growth and coarsening during discharge in lithium-oxygen batteries
Michael J Welland, Kah Chun Lau, Paul C Redfern, et al.
ACS Applied Materials & Interfaces
|
January 26, 2023
Computational Predictions of the Stability of Fluorinated Calcium Aluminate and Borate Salts
Heonjae Jeong, Ethan P Kamphaus, Paul C Redfern, et al.
The Journal of Physical Chemistry. A
|
June 30, 2021
Graph-Based Approaches for Predicting Solvation Energy in Multiple Solvents: Open Datasets and Machine Learning Models
Logan Ward, Naveen Dandu, Ben Blaiszik, et al.
The Journal of Physical Chemistry. B
|
July 21, 2006
Excited state dynamics and structures of functionalized phthalocyanines. 1. Self-regulated assembly of zinc helicenocyanine
Lin X Chen, George B Shaw, David M Tiede, et al.
The Journal of Physical Chemistry. B
|
June 3, 2020
Origin of Unusual Acidity and Li<sup>+</sup> Diffusivity in a Series of Water-in-Salt Electrolytes
Kee Sung Han, Zhou Yu, Hui Wang, et al.
Nature Materials
|
February 10, 2009
Subnanometre platinum clusters as highly active and selective catalysts for the oxidative dehydrogenation of propane
Stefan Vajda, Michael J Pellin, Jeffrey P Greeley, et al.
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Search research articles
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Showing results (11-20 of 26) with videos related to
Sort By:
Page
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Physical Chemistry Chemical Physics : PCCP
|
April 23, 2021
Theoretical evidence of water serving as a promoter for lithium superoxide disproportionation in Li-O<sub>2</sub> batteries
Nannan Shan, Paul C Redfern, Anh T Ngo, et al.
ACS Nano
|
December 14, 2017
Manipulation of Origin of Life Molecules: Recognizing Single-Molecule Conformations in β-Carotene and Chlorophyll-a/β-Carotene Clusters
Anh T Ngo, Timur Skeini, Violeta Iancu, et al.
The Journal of Physical Chemistry. A
|
July 5, 2022
Improving the Accuracy of Composite Methods: A G4MP2 Method with G4-like Accuracy and Implications for Machine Learning
Naveen K Dandu, Rajeev S Assary, Paul C Redfern, et al.
The Journal of Physical Chemistry. A
|
June 17, 2020
Quantum-Chemically Informed Machine Learning: Prediction of Energies of Organic Molecules with 10 to 14 Non-hydrogen Atoms
Naveen Dandu, Logan Ward, Rajeev S Assary, et al.
The Journal of Chemical Physics
|
December 17, 2015
An atomistically informed mesoscale model for growth and coarsening during discharge in lithium-oxygen batteries
Michael J Welland, Kah Chun Lau, Paul C Redfern, et al.
ACS Applied Materials & Interfaces
|
January 26, 2023
Computational Predictions of the Stability of Fluorinated Calcium Aluminate and Borate Salts
Heonjae Jeong, Ethan P Kamphaus, Paul C Redfern, et al.
The Journal of Physical Chemistry. A
|
June 30, 2021
Graph-Based Approaches for Predicting Solvation Energy in Multiple Solvents: Open Datasets and Machine Learning Models
Logan Ward, Naveen Dandu, Ben Blaiszik, et al.
The Journal of Physical Chemistry. B
|
July 21, 2006
Excited state dynamics and structures of functionalized phthalocyanines. 1. Self-regulated assembly of zinc helicenocyanine
Lin X Chen, George B Shaw, David M Tiede, et al.
The Journal of Physical Chemistry. B
|
June 3, 2020
Origin of Unusual Acidity and Li<sup>+</sup> Diffusivity in a Series of Water-in-Salt Electrolytes
Kee Sung Han, Zhou Yu, Hui Wang, et al.
Nature Materials
|
February 10, 2009
Subnanometre platinum clusters as highly active and selective catalysts for the oxidative dehydrogenation of propane
Stefan Vajda, Michael J Pellin, Jeffrey P Greeley, et al.
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