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v10.6.7

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@gonzex gonzex released this 09 May 17:05

DOWNLOAD : ABINIT source code (with configure) - 163MB.

Install notes, release notes, features, new user guide, abinit help, input variables, tutorial.

With respect to ABINITv10.6.5, miscellaneous bug fixes, for the compilation, for GPUs, for the the echo of variables, for CMake, etc ...

ABINIT v10.6 features : Progresses in Dynamical Mean Field Theory (DMFT) including interfacing with TRIQS; Generalized Bloch theorem to study spin spirals; New convergence criterion, suited for non-collinear magnetism studies; Born contribution ("electron-phonon") to the total energy (beyond the usual Born-Oppenheimer energy); Nuclear spin dipole coupling, indirect J coupling, control of ZORA Hamiltonian; ANADDB overhaul; Update of ABINIT to CODATA2022 version of the fundamental constants; Improvements for ARM-based systems, for GPUs ; Improvement of ABINIT build system, configure ; etc.

NB : The files "Assets" delivered below automatically by github are not to be used by normal users or developers. They do not contain the git information and some other files. For regular developers, it is advised to git clone, or even to access the ABINIT gitlab (see the instructions following the same link).