RASPA3 3.0.12
A molecular simulation code for computing adsorption and diffusion in nanoporous materials
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bond_torsion_potential Module Reference

Classes

struct  BondTorsionPotential
 Represents a bond_torsion potential between two particles. More...
 

Enumerations

enum class  BondTorsionType : std::size_t { MM3 = 0 }
 Enumeration of different bond_torsion types. More...
 

Variables

const std::size_t maximumNumberOfBondTorsionParameters {4}
 Maximum number of parameters allowed for bond_torsion potentials.
 

Files

file  src/raspakit/potentials/intramolecular/bond_torsion_potential.ixx