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Strategies for the Development of Conjugated Polymer Molecular Dynamics Force Fields Validated with Neutron and X-ray Scattering

Published

Author(s)

Caitlyn Wolf, Lorenzo Guio, Sage Scheiwiller, Viktoria Pakhnyuk, Christine Luscombe, Lilo D. Pozzo
Citation
ACS Polymers Au
Volume
1
Issue
3

Keywords

machine learning, quasi-elastic neutron scattering, molecular dynamics simulation, conjugated polymers, force field

Citation

Wolf, C. , Guio, L. , Scheiwiller, S. , Pakhnyuk, V. , Luscombe, C. and Pozzo, L. (2021), Strategies for the Development of Conjugated Polymer Molecular Dynamics Force Fields Validated with Neutron and X-ray Scattering, ACS Polymers Au (Accessed May 27, 2024)

Issues

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Created December 7, 2021, Updated November 29, 2022