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ChangeLog.md

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Changelog

All notable changes to this project will be documented in this file.

The format is based on Keep a Changelog, and this project adheres to Semantic Versioning.

[0.7.1-1] - 2023-02-08

Changed

  • Libmdb v0.12.6.

[0.7.0-1] - 2022-09-20

Added

  • LibDFTB+ v21.1.

Changed

  • ELSI to v2.7.1.
  • Libmdb v0.12.1.
  • Spglib v1.16.2.
  • ELPA v2021.05.002.
  • NTPoly to v2.7.0.

[0.6.1-3] - 2022-08-11

Fixed

  • Missing OMM dependency for ELSI.

[0.6.1-2] - 2021-10-15

Fixed

  • Misspelled name of the ELSI-RCI package in the module sets.

[0.6.1-1] - 2021-05-14

Changed

  • Spglib to v1.16.1.
  • ELPA to v2020.11.001.

[0.6.0-1] - 2020-03-12

Added

  • BSEPACK v0.1.
  • Libmdb v0.10.2.

Changed

  • Libpsml to v1.1.10.
  • LibGridXC to v0.9.6.
  • NTPoly to v2.5.1.
  • ELSI to v2.6.4.
  • ELPA to v2020.05.001.
  • scotch to v6.1.0.
  • Sgplib to v1.16.0.
  • Wannier90 to 3.1.0.

[0.5.0-1] - 2020-05-08

Added

  • sgplib v1.14.1
  • wannier90 v3.0.0
  • ELSI-RCI v0.1.0
  • MatrixSwitch v1.0.0 as a stand-alone library.
  • LibOMM v1.0.0 as a stand-alone library.
  • install-bundle wrapper to make the use of JHBuild easier.

Changed

  • Fdict to v0.8.0.
  • Flook to v0.8.1.
  • Libfdf to v0.2.2.
  • LibGridXC to v0.9.5
  • NTPoly to v2.4.0
  • SuperLU_DIST to v6.2.0
  • ELSI to v2.5.0
  • JHBuild to a new version supporting Python 3.

[0.4.2-1] - 25-02-2020

Changed

  • LibPSML to v1.1.9.
  • ELPA to v2019.05.002.

[0.4.1-1] - 2020-02-22

Fixed

  • URLs of several package websites.

Changed

  • LibPSML to v1.1.8.

[0.4.0-1] - 2020-02-21

Fixed

  • Compilation of Futile with recent intel compilers.
  • Installation of Flook and Fdict on MacOS.

Changed

  • LibGridXC with autotoolized build system to 0.8.5.1.
  • Fdict to v0.7.1.
  • libvdwxc to v0.4.0.
  • Libxc to v4.3.4.
  • ELPA to v2019.05.001.
  • NTPoly to v2.3.1.
  • SuperLU_DIST to v6.1.1.
  • ELSI to v2.3.1
  • PEXSI to v1.2.0.

[0.3.1-2] - 2019-01-18

Added

  • Documentation about the bundle release process.

[0.3.1-1] - 2019-01-17

Fixed

  • Name of Libvdwxc in documentatation.
  • ChangeLog.
  • LibGridXC build-system by updating to v0.8.4.2.

Changed

  • Futile to align it with upstream BigDFT/Futile v1.8.3.
  • PSolver to align it with upstream BigDFT/PSolver v1.8.3.

[0.3.0-2] - 2019-01-15

Added

  • Configuration files: ubuntu-gcc-serial.rc, ubuntu-gcc-openmpi.rc, fedora-gcc-serial.rc, fedora-gcc-openmpi.rc, centos-gcc-serial.rc, centos-gcc-openmpi.rc.

[0.3.0-1] - 2019-01-14

Added

  • Libvdwxc v0.3.2.
  • NTPoly v2.1.
  • PEXSI as a stand-alone library.

Changed

  • Fdict to v0.6.0.
  • Libxc to v4.2.3.
  • LibGridXC to v0.8.4.
  • ELSI to v2.1.0.
  • ELPA to v2018.11.001.
  • PEXSI to v1.0.3.
  • scotch to v6.0.0.

Removed

  • libyaml v0.1.6.

[0.2.0-4] - 2019-01-14

Fixed

  • Incorrect Python requirements in documentation.

[0.2.0-3] - 2019-01-12

Fixed

  • Incorrect ELPA version number in documentation.
  • Bug in configuration files: compilation of xmlf90 was failing with GCC because of long lines.

[0.2.0-2] - 2019-01-12

Fixed

  • Typo in documentation.

[0.2.0-1] - 2018-07-09

Added

  • ELPA as a stand-alone library.
  • Author and license information for scotch and superlu_dist.
  • Configuration files: debian-gcc-serial.rc, opensuse-gcc-serial.rc.

Changed

  • ELSI to v2.0.2
  • ELPA to v2018.05.001.
  • Configuration files for new ELSI version.

Fixed

  • Incorrect scotch version number in documentation.

[0.1.0] - 2018-06-07

Added

  • Fdict v0.5.0.
  • Flook v0.7.0.
  • Futile v1.8.
  • Libfdf v0.1.1.
  • Libpsml v1.1.7.
  • Libxc v3.0.1.
  • libGridXC v0.8.0.3.
  • PSolver v1.8.1.
  • pspio v0.2.4.
  • xmlf90 v1.5.4.
  • libyaml v0.1.6.
  • ELSI v180205.
  • ELPA v2016.11.001.
  • LibOMM (included in ELSI).
  • MatrixSwitch (included in ELSI).
  • PEXSI (included in ELSI).
  • SIPs (included in ELSI).
  • superlu_dist v5.3.0.
  • scotch v6.0.4
  • esl module set.
  • esl-bundle and esl-bundle-mpi meta-modules.
  • Configuration files: debian-gcc-openmpi.rc, gfortran+mpi.rc, opensuse-gcc-openmpi.rc.