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Delocalization of exciton and electron wavefunction in non-fullerene acceptor molecules enables efficient organic solar cells

Nature communications, 2020-08, Vol.11 (1), p.3943-3943, Article 3943

2020

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NLDFT Pore Size Distribution in Amorphous Microporous Materials

Langmuir, 2017-10, Vol.33 (42), p.11138-11145

2017

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Organic Photovoltaics: Relating Chemical Structure, Local Morphology, and Electronic Properties

Trends in chemistry, 2020-06, Vol.2 (6), p.535-554

2020

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Modeling Amorphous Microporous Polymers for CO2 Capture and Separations

Chemical reviews, 2018-06, Vol.118 (11), p.5488-5538

2018

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Plasticization behavior in polymers of intrinsic microporosity (PIM-1): A simulation study from combined Monte Carlo and molecular dynamics

Journal of membrane science, 2018-11, Vol.565 (C), p.95-103

2018

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Rapid Prediction of Adsorption Isotherms of a Diverse Range of Molecules in Hyper-Cross-Linked Polymers

Journal of physical chemistry. C, 2019-07, Vol.123 (29), p.17884-17893

2019

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Rapid Prediction of Adsorption Isotherms of a Diverse Range of Molecules in Hyper-Cross-Linked Polymers

Journal of physical chemistry. C, 2019-06, Vol.123 (29)

2019

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Pore size tuning of poly(styrene-co-vinylbenzyl chloride-co-divinylbenzene) hypercrosslinked polymers: Insights from molecular simulations

Polymer (Guilford), 2016-09, Vol.99, p.173-184

2016

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Resolving Atomic‐Scale Interactions in Nonfullerene Acceptor Organic Solar Cells with Solid‐State NMR Spectroscopy, Crystallographic Modelling, and Molecular Dynamics Simulations

Advanced materials (Weinheim), 2022-02, Vol.34 (6), p.e2105943-n/a

2022

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Low Energetic Disorder in Small-Molecule Non-Fullerene Electron Acceptors

ACS materials letters, 2019-09, Vol.1 (3), p.350-353

2019

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A molecular dynamics study of water-soluble polymers: analysis of force fields from atomistic simulations

Molecular simulation, 2019-03, Vol.45 (4-5), p.310-321

2019

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Modeling Amorphous Microporous Polymers for CO^sub 2^ Capture and Separations

Chemical reviews, 2018-06, Vol.118 (11), p.5488

2018

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Resolving atomic-scale interactions in non-fullerene acceptor organic solar cells with solidstate NMR spectroscopy, crystallographic modelling, and molecular dynamics simulations

Advanced materials (Weinheim), 2022-02, Vol.34 (6)

2022

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Modeling Amorphous Microporous Polymers for CO 2 Capture and Separations

Chemical reviews, 2018-06, Vol.118 (11), p.5488-5538

2018

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Molecular Packing in the Active Layers of Organic Solar Cells Based on Non-Fullerene Acceptors: Impact of Isomerization on Charge Transport, Exciton Dissociation, and Nonradiative Recombination

ACS applied energy materials, 2021-04, Vol.4 (4), p.4002-4011

2021

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A molecular dynamics study of water-soluble polymers: analysis of force fields from atomistic simulations

Molecular simulation, 2018-10, Vol.45 (4-5)

2018

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Experimental and Computation Studies of the Reaction of Hydrogen Peroxide and Methyl Hydroperoxide on Molybdenum Hydrogen Bronze Surfaces

Topics in catalysis, 2018-06, Vol.61 (9-11), p.1183-1192

2018

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Snapshots of LifeEarly Career Materials Scientists Managing in the Midst of a Pandemic

Chemistry of materials, 2020-05, Vol.32 (9), p.3673-3677

2020

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Identification of Excipients for Stabilizing Fiberless Adenovirus as Biopharmaceuticals

Journal of pharmaceutical sciences, 2017-07, Vol.106 (7), p.1764-1771

2017

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Effect of Fiber Truncations on the Stability of Adenovirus Type 5

Molecular biotechnology, 2014-11, Vol.56 (11), p.979-991

2014

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The effect of fiber truncations on the stability of Adenovirus type 5

Kupgan, Grit

2013

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Delocalization of exciton and electron wavefunction in non-fullerene acceptor molecules enables efficient organic solar cells

NLDFT Pore Size Distribution in Amorphous Microporous Materials

Organic Photovoltaics: Relating Chemical Structure, Local Morphology, and Electronic Properties

Modeling Amorphous Microporous Polymers for CO2 Capture and Separations

Plasticization behavior in polymers of intrinsic microporosity (PIM-1): A simulation study from combined Monte Carlo and molecular dynamics

Rapid Prediction of Adsorption Isotherms of a Diverse Range of Molecules in Hyper-Cross-Linked Polymers

Rapid Prediction of Adsorption Isotherms of a Diverse Range of Molecules in Hyper-Cross-Linked Polymers

Pore size tuning of poly(styrene-co-vinylbenzyl chloride-co-divinylbenzene) hypercrosslinked polymers: Insights from molecular simulations

Resolving Atomic‐Scale Interactions in Nonfullerene Acceptor Organic Solar Cells with Solid‐State NMR Spectroscopy, Crystallographic Modelling, and Molecular Dynamics Simulations

Low Energetic Disorder in Small-Molecule Non-Fullerene Electron Acceptors

A molecular dynamics study of water-soluble polymers: analysis of force fields from atomistic simulations

Modeling Amorphous Microporous Polymers for CO^sub 2^ Capture and Separations

Resolving atomic-scale interactions in non-fullerene acceptor organic solar cells with solidstate NMR spectroscopy, crystallographic modelling, and molecular dynamics simulations

Modeling Amorphous Microporous Polymers for CO 2 Capture and Separations

Molecular Packing in the Active Layers of Organic Solar Cells Based on Non-Fullerene Acceptors: Impact of Isomerization on Charge Transport, Exciton Dissociation, and Nonradiative Recombination

A molecular dynamics study of water-soluble polymers: analysis of force fields from atomistic simulations

Experimental and Computation Studies of the Reaction of Hydrogen Peroxide and Methyl Hydroperoxide on Molybdenum Hydrogen Bronze Surfaces

Snapshots of LifeEarly Career Materials Scientists Managing in the Midst of a Pandemic

Identification of Excipients for Stabilizing Fiberless Adenovirus as Biopharmaceuticals

Effect of Fiber Truncations on the Stability of Adenovirus Type 5

The effect of fiber truncations on the stability of Adenovirus type 5

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