opan.vpt2

Submodule implementing VPT2 anharmonic computations.

Warning

This module is under active development. API &c. may change with little notice.

Sub-Modules

repo – HDF5 repository for OpanVPT2

Classes

OpanVPT2 – Core driver class for VPT2 anharmonic calculations.

API

class opan.vpt2.base.OpanVPT2

Container for data from VPT2 anharmonic calculations.

To be added…