mctools/ncrystal

Issues

• Migrate highness plugin functionality to core NCrystal

  #194 opened 2 days ago by tkittel
  0

• Dynamic Plugin mechanism seems to give problems on osx

  #193 opened 2 days ago by tkittel
  0

• Google colab gives weird error when gemmi/spglib are imported

  #192 opened 2 days ago by tkittel
  0

• CI of notebooks green despite failure

  #191 opened 3 days ago by tkittel
  1

• CMake warning when compiling plugins in google colab

  #190 opened 8 days ago by tkittel
  0

• Bug in PhononDOSAnalyser

  #187 opened 15 days ago by marquezj
  2

• Inconsistent structure formula loaded from CIF

  #128 opened 16 days ago by nicriz
  3

• Support for intel compilers

  #146 opened 21 days ago by KBGrammer
  21

• Material with large atom numbers will result in error when using the default d-spacing 0.2 Angstrom

  #160 opened 21 days ago by XuShuqi7
  7

• Compile with -fno-math-errno

  #169 opened 21 days ago by tkittel
  3

• Provide analyseVDOS() for DI_VDOSDebye objects

  #174 opened 21 days ago by marquezj
  5

• Density bug in multiphase-materials with both density and scatter keywords

  #182 opened 21 days ago by tkittel
  7

• np.asfarray error due to numpy 2.0.0

  #185 opened 21 days ago by MilanKlausz
  2

• return information from hklList in a python structure

  #164 opened 21 days ago by soerenschmidts
  5

• Versioned shared libraries installed by the Python package aren't shared links, but copies of each other

  #186 opened 22 days ago by yurivict
  6

• SAB table format description

  #170 opened 3 months ago by dddijulio
  9

• ncmat2endf script

  #183 opened 3 months ago by marquezj
  0

• endf2ncmat could use endf-parserpy

  #184 opened 3 months ago by marquezj
  0

• AtomDB as an external file

  #177 opened 5 months ago by marquezj
  7

• Support dir2=auto

  #156 opened 9 months ago by tkittel
  0

• vdos2ncmat should have a nicer error in case of missing numpy

  #181 opened 4 months ago by tkittel
  0

• High energy limit should be linear combination of be the free atom cross section of isotopes

  #176 opened 5 months ago by marquezj
  5

• Maximum beta is not Emax/kT when exporting S(a,b) from Info object

  #179 opened 4 months ago by marquezj
  0

• cppcheck issues

  #165 opened 4 months ago by tkittel
  1

• PG-mode for beryllium exposes numerical integration issue

  #171 opened 4 months ago by tkittel
  4

• Add optional process support for biased sampling (for focus, point detectors, etc).

  #175 opened 5 months ago by tkittel
  2

• conda-forge ncrystal packages should not depend on python version

  #140 opened a year ago by tkittel
  2

• Add ABI complience checker

  #173 opened 5 months ago by tkittel
  1

• Need out of the box solutions for steel

  #161 opened 7 months ago by tkittel
  1

• Create new dedicated data-library website

  #168 opened 6 months ago by tkittel
  2

• manylinux_2_28 pypi pkgs missing

  #166 opened 6 months ago by tkittel
  9

• Spurious failure in some dos-expansion related unit tests

  #167 opened 6 months ago by tkittel
  1

• update notebooks

  #163 opened 7 months ago by tkittel
  1

• Provide B4C and Gd2O3 for completeness.

  #162 opened 7 months ago by tkittel
  2

• Several shell scripts are installed into $PREFIX

  #150 opened 8 months ago by yurivict
  5

• Need periodic systematic check against upstream databases

  #159 opened 8 months ago by tkittel
  0

• Explicitly forbid # and $ in cfg-strings

  #153 opened 9 months ago by tkittel
  2

• Support windows

  #154 opened 10 months ago by tkittel
  0

• The python extension installs the C++ library

  #151 opened 10 months ago by yurivict
  11

• Consider a more clean split between Python and non-Python parts of an NCrystal installation.

  #152 opened 10 months ago by tkittel
  0

• Update constants for NIST/CODATA 2022

  #149 opened 10 months ago by tkittel
  1

• Support energy-dependent atom data

  #147 opened a year ago by tkittel
  5

• Make natural abundances available

  #145 opened a year ago by tkittel
  0

• Consider CITATION.cff

  #139 opened a year ago by tkittel
  0

• Write ENDF format

  #129 opened a year ago by dddijulio
  11

• Update documentation for new pythonic installation mechanism

  #134 opened a year ago by tkittel
  3

• gcc12 compilation issues prevent conda deployment

  #125 opened a year ago by tkittel
  2

• Add setup-ncrystal.sh instead of setup.sh

  #126 opened a year ago by tkittel
  2

• Setup systematic testing with ruff

  #138 opened a year ago by tkittel
  0

• Labels and elements in NCMATComposer objects from CIF

  #124 opened a year ago by marquezj
  1