ase_interface

This is summary documentation for hippynn.interfaces.ase_interface module. Click here for full documentation.

API Summary for sub-modules:

• ase_database
• ase_unittests
• calculator
• pairfinder

Links to Full Documentation:

For using hippynn with the Atomic Simulation Environment (ASE)

Modules

ase_database	Dataset stored as ase database file (ideally either .json or .db, or in .xyz, .extxyz formats)
ase_unittests	Unit tests for ASE Graph construction.
calculator
pairfinder