Lennard-Jones-FJC model thermodynamics (isometric/asymptotic/reduced)
- class LENNARDJONESFJC(number_of_links, link_length, hinge_mass, link_stiffness)
The Lennard-Jones link potential freely-jointed chain (Lennard-Jones-FJC) model thermodynamics in the isometric ensemble approximated using an asymptotic approach.
- number_of_links
The number of links in the chain.
- link_length
The length of each link in the chain in units of nm.
- hinge_mass
The mass of each hinge in the chain in units of kg/mol.
- link_stiffness
The stiffness of each link in the chain in units of J/(mol⋅nm^2).
- legendre
The thermodynamic functions of the model in the isometric ensemble approximated using a reduced asymptotic approach and a Legendre transformation.