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JuliaMolSim / AtomsCalculatorsUtilities.jl

Utilities for implementing AtomsCalculators
MIT License
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basic calculators #1

Closed tjjarvinen closed 3 months ago

tjjarvinen commented 5 months ago

This adds basic calculator that where originally defined in https://github.com/JuliaMolSim/AtomsCalculators.jl/pull/9

There are some changes to the original definition.

This PR lacks documentation. But that can be added later.