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Project
Modeling long-range correlation energies in extended systems: Monopolar charge fluctuations
Information
Project Team
Outputs and Outcomes
Publications
The tale of HORTON : lessons learned in a decade of scientific software development
Matthew Chan
Toon Verstraelen
Alireza Tehrani
Michelle Richer
Xiaotian Derrick Yang
Taewon David Kim
Esteban Vöhringer-Martinez
Farnaz Heidar Zadeh
Paul W. Ayers
A1
Journal Article
in
JOURNAL OF CHEMICAL PHYSICS
2024
The significance of fluctuating charges for molecular polarizability and dispersion coefficients
YingXing Cheng
Toon Verstraelen
A1
Journal Article
in
JOURNAL OF CHEMICAL PHYSICS
2023
A new framework for frequency-dependent polarizable force fields
YingXing Cheng
Toon Verstraelen
A1
Journal Article
in
JOURNAL OF CHEMICAL PHYSICS
2022