Releases: jaclark5/mapsci
Releases · jaclark5/mapsci
mapsci-v0.0.3
The first release of MAPSCI: Multipole Approach of Predicting and Scaling Cross Interactions.
MAPSCI is an importable package that can be used to estimate cross-interaction parameters for the Mie potential using multipole moments. This is useful for the SAFT-𝛾-Mie equation of state, as well as Molecular Dynamics and Monte Carlo simulation methods.