This package contains a type of NQCModel which takes a Matrix of positions and potential values as an input to fit a spline to.
Currently, only a one-dimensional adiabatic model is implemented: CSVModel_1D
Importing the table of positions and potential values is left to the user since CSV files come in too many different flavours.
nqcd / csvmodels.jl Goto Github PK
View Code? Open in Web Editor NEWFit a spline through a table of potential values and positions (Currently only 1D)
License: MIT License