Dielectric response with short-ranged electrostatics (data set)
MetadataShow full item record
Cox, S. (2020). Dielectric response with short-ranged electrostatics (data set) [Dataset]. https://doi.org/10.17863/CAM.52565
See README file for a detailed description of this dataset. This directory contains the LAMMPS input files, both with Ewald sums and LMFT. There are two subdirectories: 'BulkResponse' – Simulations of bulk liquid water; 'Slab' – Simulations for water confined between hydrophobic walls.
LAMMPS (https://lammps.sandia.gov) See also: https://github.com/uccasco/LMFT https://github.com/uccasco/FiniteFields
statistical mechanics, dielectrics, polar fluids, local molecular field theory
Royal Commission for the Exhibition of 1851
This record's DOI: https://doi.org/10.17863/CAM.52565