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mcaroba/turbogap

0
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21 Stars·14 Forks·Fortran·6 Aufrufe

Turbogap

TurboGAP (c) 2018-2023 by Miguel A. Caro and others (see "contributors" below for detailed authorship info).

Features

  • Interatomic Potentials - Code for Gaussian Approximation Potentials.

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Häufig gestellte Fragen

Was macht mcaroba/turbogap?

TurboGAP (c) 2018-2023 by Miguel A. Caro and others (see "contributors" below for detailed authorship info).

Was sind die Hauptfunktionen von mcaroba/turbogap?

Die Hauptfunktionen von mcaroba/turbogap sind: Interatomic Potentials.

Welche Open-Source-Alternativen gibt es zu mcaroba/turbogap?

Open-Source-Alternativen zu mcaroba/turbogap sind unter anderem: lammps/lammps — This project is a parallel simulation engine and molecular dynamics simulator designed to model the physical movements… acesuit/acefit.jl — Generic Codes for Fitting ACE models. acesuit/mace — MACE - Table of contents - About MACE - Documentation - Installation - pip installation - pip installation from source… aiqm/torchani — TorchANI 2.0 is an open-source library that supports training, development, and research of ANI-style neural network… apax-hub/apax — apax[^1][^2] is a high-performance, extendable package for training of and inference with atomistic neural networks.… acesuit/ace1.jl — Notes: This is currently a development branch of ACE (though we are still tagging versions regularly). For the latest…