mfherbst / 2022-rwth-julia-workshopLinks
Material for the RWTH Julia workshop on 17th and 18th February 2022
☆22Updated 2 years ago
Alternatives and similar repositories for 2022-rwth-julia-workshop
Users that are interested in 2022-rwth-julia-workshop are comparing it to the libraries listed below
Sorting:
- Simulation codes shown at the FortranCon 2021☆22Updated last year
- A collection of basic routines for Molecular Dynamics simulations implemented in Julia☆12Updated 7 months ago
- A Julian toolkit for solid-state chemical theory.☆31Updated 11 months ago
- Learning how to code a package for solving simple Hartree-Fock electronic structure calculations.☆20Updated 5 years ago
- ☆38Updated last week
- A mathematical look on density-functional theory and DFTK☆34Updated 3 years ago
- Registry for Molecular Simulation Packages☆11Updated 2 years ago
- Julia language implementation of the Cell Lists algorithm to solve the fixed-radius near neighbors problem including serial and multithre…☆19Updated 3 years ago
- An interface for generating simple crystal structures for molecular dynamics simulations.☆16Updated last week
- Electronic structure calculations using Julia☆14Updated 3 years ago
- Contains methods and types for a variety of interatomic potentials.☆29Updated last month
- Fundamental scientific algorithms in Julia☆33Updated 3 years ago
- Electrochemical reaction rate modeling and nonequilibrium phase maps (via AD)☆23Updated last year
- Extended XYZ read/write support for Julia☆16Updated 6 months ago
- Manage a Julia project living within a Python package☆17Updated last year
- Julia bindings to the libxc library for exchange-correlation functionals☆22Updated 2 months ago
- An extension of Unitful.jl for working with atomic units☆21Updated last year
- PotentialLearning.jl: Optimize your atomistic data and interatomic potential models in your molecular dynamics workflows.☆20Updated 7 months ago
- A Julian abstract interface for atomistic calculators.☆16Updated 7 months ago
- Julia Library for Interatomic Potentials☆85Updated 2 months ago
- Yet another package for computing multidimensional non-uniform fast Fourier transforms (NUFFTs) in Julia☆12Updated this week
- A generic and fast solver of mode-coupling theory-like integrodifferential equations☆18Updated 2 months ago
- working with crystal structures☆21Updated 11 months ago
- Standard input/output package for AtomsBase-compatible structures☆22Updated 6 months ago
- A set of tools for analyzing molecular dynamics simulations☆10Updated 2 weeks ago
- A short lecture introducing plane-wave DFT methods and DFTK☆12Updated 3 years ago
- ☆12Updated 7 months ago
- Julia code for the computation of Wannier functions☆23Updated 6 years ago
- Material of the seminar "Julia for Materials Modelling"☆29Updated 2 years ago
- ☆12Updated last year