Changelog

February 2. 2012 - version 1.6.0↑ Return on top

Official 1.6.0 version released for the tutorial in Oak Ridge

• bigdft-1.6.0.tar.gz (source tarball)

This version has been released for the tutorial in Oak Ridge.

October 19. 2011 - version 1.6-tuto↑ Return on top

Official (pre) 1.6 version released for the CECAM tutorial

• bigdft-1.6-tuto.tar.gz (source tarball)

This version has been released for the CECAM tutorial and contains most of the attended features of the full 1.6 version.

April 22. 2011 - version 1.5.2↑ Return on top

Correction version

• bigdft-1.5.2.tar.gz (source tarball)

This version corrects some bugs combining MPI, openCL and OpenMP features. The mixing scheme for metallic treatment seems robust. The time-dependent DFT is fully operational.

March 25. 2011 - version 1.5.1↑ Return on top

Correction version

• bigdft-1.5.1.tar.gz (source tarball)

This version corrects some bugs combining MPI, openCL and OpenMP features. The mixing scheme for metallic treatment needs more intensive tests.

Browse the latest src source (1.5.1).

March 21. 2011 - version 1.5.0↑ Return on top

New version

• bigdft-1.5.0.tar.gz (source tarball)

This version has many new features as metallic treatment, Time-Dependent-DFT and full OpenCL support (GPU acceleration).

June 2010 - version 1.4.0↑ Return on top

New version

• bigdft-1.4.0.tar.gz (source tarball)

This version has many new features as hybrid functionals, XANES calculations and can use OpenCL library for GPGPU.

January 2010 - version 1.3.2↑ Return on top

Correction version

• bigdft-1.3.2.tar.gz (source tarball)

This version corrects mistakes in the tests suite and the documentation build. It also removes the mandatory usage of second underscore when compiling with CUDA.

December 2009 - version 1.3.1↑ Return on top

Correction version

• bigdft-1.3.1.tar.gz (source tarball)

This version corrects a bug in GPU calculation and add a NEB manual.

July 2009 - version 1.3.0↑ Return on top

Production version

• bigdft-1.3.0.tar.gz (source tarball)

This version includes a better CUDA support, more functional thanks to libXC, quicker periodic performances, dispersion forces, simple vibrational properties, saddle point calculations (NEB)...

March 2011 - version 1.2.0.4↑ Return on top

Maintenance version for ABINIT

• bigdft-1.2.0.4.tar.gz (source tarball)

This version is purely a maintenance version, including patches on the build system for a finer integration with ABINIT 6.x.

May 2009 - version 1.2.0.1↑ Return on top

Correction version (included in ABINIT 5.8)

• bigdft-1.2.0.1.tar.gz (source tarball)

January 2009 - version 1.2.0↑ Return on top

Stable version (included in ABINIT 5.7)

• bigdft-1.2.0.tar.gz (source tarball)

September 2008 - version 1.1.9 (development version)↑ Return on top

• bigdft-1.1.9.tar.gz (source tarball)