JOSS Papers: crystallography

All Papers
4084
 Published Papers
3674
 Active Papers
410
published Published 7 days ago

parsnip: Streamlined Crystallographic Data Parsing for Assembly Science and Engineering

Python
@janbridley
10.21105/joss.10407
published Published 2 months ago

crystract: A Crystallography Package in R for .cif Data Processing

R
@don-tat
10.21105/joss.09529
published Published 3 months ago

site-analysis: A Python package for site-projection analysis of molecular dynamics trajectories

Python Jupyter Notebook
@bjmorgan
10.21105/joss.09606
published Published 7 months ago

Open Computational Chemistry (OCC) - A portable software library and program for quantum chemistry and crystallography

C++ C
@peterspackman
10.21105/joss.09609
published Published about 1 year ago

SAnTex: A Python-based Library for Seismic Anisotropy Calculation

Jupyter Notebook Python
@utpal-singh
10.21105/joss.06886
published Published almost 2 years ago

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

Python Jupyter Notebook
@bobleesj
10.21105/joss.07205
published Published almost 2 years ago

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

Python
@mzkhalid039
10.21105/joss.06895
published Published almost 3 years ago

PASCal Python: A Principal Axis Strain Calculator

Python
@MJCliffe
10.21105/joss.05556
published Published about 3 years ago

spgrep: On-the-fly generator of space-group irreducible representations

Python
@lan496
10.21105/joss.05269
published Published over 4 years ago

GEMMI: A library for structural biology

C++ Fortran
@wojdyr
10.21105/joss.04200
Displaying papers 1 - 10 of 13 in total

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ISSN 2475-9066