January 2024 Release

This release consolidates some essentially cosmetic changes to programs and documentation, and also includes the correction discussed in Issue #19.

September 2022 Release

This release consolidates some minor changes to the documentation and a few program files. The most significant change is the retirement of the init_random_seed wrapper, which was only really needed by users of gfortran v6 (and earlier), and should now be redundant.

October 2020 Release

This release incorporates a bugfix for Issue #16 as well as some minor updates to the documentation.

January 2020 Release

This release incorporates a small number of minor improvements to NPT and zVT simulation codes. There are also some accumulated changes in the documentation, including links to cited publications, and corrections to a few typos in the program comments.

October 2017 Release

This release consolidates the addition of Python versions of several examples, a molecular dynamics code for rigid molecules using quaternions, and a bug fix. In addition, following on from the release of gfortran v7, which included a new built-in random number generator, the GNU-specific init_random_seed routine in maths_module.f90 has been replaced by one which simply calls random_seed(). The previous workaround can be found in gnu_v6_init_random_seed.f90 for information.

No further additions to the codes are currently planned, so new releases in the foreseeable future should be confined to bug fixes and, possibly, accumulated cosmetic changes in the documentation and/or program files.

September 2017 Release (2)

This release incorporates a bug-fix to maths_module.py and some minor edits in the documentation.

September 2017 Release

This release incorporates additional Python versions, a couple of bugfixes covered in recent commits, and some improvements to the documentation.

August 2017 Release

This release includes several additional Python versions of codes which were omitted in the original production release.

Initial production release

Initial release, with large data file transferred to data repository, and minor edits to accompanying text files.

Initial release with large data file removed

No changes to source code. Moved large data file grint_data.zip to separate data repository.