Source: pyxrd
Maintainer: Debian PaN Maintainers <debian-pan-maintainers@alioth-lists.debian.net>
Uploaders:
 Debian Science Maintainers <debian-science-maintainers@lists.alioth.debian.org>,
 Roland Mas <lolando@debian.org>
Section: science
Priority: optional
Build-Depends: dh-python, python3, python3-setuptools,
 python3-setuptools-git, python3-mock, python3-gi, gir1.2-gtk-3.0,
 python3-numpy, python3-scipy, python3-cairocffi, python3-matplotlib, python3-deap,
 debhelper (>= 13)
Standards-Version: 4.5.1
Homepage: https://github.com/PyXRD/PyXRD
Vcs-Git: https://salsa.debian.org/science-team/pyxrd.git
Vcs-Browser: https://salsa.debian.org/science-team/pyxrd

Package: python3-pyxrd
Architecture: any
Depends: ${misc:Depends}, ${python3:Depends}, ${shlibs:Depends}
Description: modeling of X-ray diffraction (XRD) patterns of disordered lamellar structures
 python implementation of the matrix algorithm for computer modeling
 of X-ray diffraction (XRD) patterns of disordered lamellar
 structures. It's goals are to:
  - provide an easy user-interface for end-users
  - provide basic tools for displaying and manipulating XRD patterns
  - produce high-quality (publication-grade) figures
  - make modelling of XRD patterns for mixed-layer clay minerals 'easy'
  - be free and open-source (open box instead of closed box model)
 .
 PyXRD was written with the multi-specimen full-profile fitting method
 in mind. A direct result is the ability to 'share' parameters among
 similar phases. This allows for instance to have an air-dry and a
 glycolated illite-smectite share their coherent scattering domain
 size, but still have different basal spacings and interlayer
 compositions for the smectite component. Or play with the
 di/tri-octahedral composition of a chlorite with ease.