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RSC Advances|June 15, 2022
Correction: Introducing DDEC6 atomic population analysis: part 1. Charge partitioning theory and methodologyThomas A Manz, Nidia Gabaldon LimasRSC Advances|May 11, 2022
Introducing DDEC6 atomic population analysis: part 4. Efficient parallel computation of net atomic charges, atomic spin moments, bond orders, and moreNidia Gabaldon Limas, Thomas A ManzRSC Advances|May 6, 2022
New scaling relations to compute atom-in-material polarizabilities and dispersion coefficients: part 1. Theory and accuracyThomas A Manz, Taoyi Chen, Daniel J Cole, et al.Journal of Chemical Theory and Computation|November 20, 2015
Expanding the Scope of Density Derived Electrostatic and Chemical Charge Partitioning to Thousands of AtomsLouis P Lee, Nidia Gabaldon Limas, Daniel J Cole, et al.Pageof 1