JOSS Papers: edited by @rkurchin

Published Papers

published Published 21 days ago

pengWann: Descriptors of chemical bonding from Wannier functions

Rust Python

@PatrickJTaylor

10.21105/joss.07890

published Published 27 days ago

venco.py: A Python model to represent the charging flexibility and vehicle-to-grid potential of electric vehicles in energy system models

Python

10.21105/joss.06896

published Published 6 months ago

cifkit: A Python package for coordination geometry and atomic site analysis

Python Jupyter Notebook

10.21105/joss.07205

published Published 7 months ago

AutoBZ.jl: Automatic, adaptive Brillouin zone integration using Wannier interpolation

Julia

10.21105/joss.07080

published Published 9 months ago

DWBuilder: A code to generate ferroelectric/ferroelastic domain walls and multi-material atomic interface structures

Python

10.21105/joss.06895

published Published 10 months ago

IonDiff: command-line tool to identify ionic diffusion events and hopping correlations in molecular dynamics simulations

Python

10.21105/joss.06616

published Published 12 months ago

PourPy - A python package to generate potential-pH diagrams

Python Jupyter Notebook

10.21105/joss.06536

published Published 12 months ago

Taweret: a Python package for Bayesian model mixing

10.21105/joss.06175

published Published about 1 year ago

doped: Python toolkit for robust and repeatable charged defect supercell calculations

Python Ruby Jupyter Notebook

10.21105/joss.06433

published Published about 1 year ago

plotastic: Bridging Plotting and Statistics in Python

Jupyter Notebook Python

10.21105/joss.06304

Displaying papers 1 - 10 of 43 in total

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