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MOLSCAT is a general-purpose package for performing non-reactive quantumscattering calculations for atomic and molecular collisions usingcoupled-channel methods. Simple atom-molecule and molecule-molecule collisiontypes are coded internally and additional ones may be handled with plug-inroutines. Plug-in routines may include external magnetic, electric or photonfields (and combinations of them). Simple interaction potentials are codedinternally and more complicated ones may be handled with plug-in routines.  BOUND is a general-purpose package for performing calculations of bound-stateenergies in weakly bound atomic and molecular systems using coupled-channelmethods. It solves the same sets of coupled equations as MOLSCAT, and can usethe same plug-in routines if desired, but with different boundary conditions.  FIELD is a development of BOUND that locates external fields at which a boundstate exists with a specified energy. One important use is to locate thepositions of magnetically tunable Feshbach resonance positions in ultracoldcollisions.  Versions of these programs before version 2019.0 were released separately.However, there is a significant degree of overlap between their internalstructures and usage specifications. This manual therefore describes all three,with careful identification of parts that are specific to one or two of theprograms.

User Manual for MOLSCAT, BOUND and FIELD, Version 2022.0: programs for  quantum scattering properties and bound states of interacting pairs of atoms  and molecules