Teemu Järvinen's repositories
1d-experiments
an experimental grid based 1D SCF+SDCI program
Language:C++000
ACE1.jl
Atomic Cluster Expansion for Modelling Invariant Atomic Properties
Language:Julia000
ACEcore.jl
Some of the core computational kernels for building ACE models
Language:JuliaMIT000
ACEfit.jl
Generic Codes for Fitting ACE models
Language:JuliaMIT000
Language:JuliaMIT000
ACEregistry
Our registry for ACE Julia packages under development
MIT000
Language:JuliaMIT000
gimic
Gauge-including magnetically induced currents.
Language:PythonGPL-2.0000
JuLIP.jl
Julia Library for Interatomic Potentials
Language:JuliaNOASSERTION000
ACEpotentials.jl
A complete pack of cards, all aces
Language:JuliaMIT000
Language:PythonMIT000
MIT000
AtomsIO.jl
Standard input/output package for AtomsBase-compatible structures
MIT000
ExtXYZ.jl
Extended XYZ read/write support for Julia
Language:JuliaMIT000
Molly.jl
Molecular simulation in Julia
Language:JuliaNOASSERTION000
NeighbourLists.jl
neighbour list for particle simulations based on matscipy
Language:JuliaNOASSERTION000
Polynomials4ML.jl
Polynomials for ML: fast evaluation, batching, differentiation
MIT000
sphericart
Multi-language library for the calculation of spherical harmonics in Cartesian coordinates
Language:C++Apache-2.0000