ALAMODE version 1.0.2 (2018-1-29)

ttadano released this 29 Jan 13:40

· 793 commits to develop since this release

New

Phonon band connection by eigenvector similarity (BCONNECT tag)
New option to turn on/off the symmetrization of Born effective charge (BORNSYM tag).

Changes

Improve the performance of the "suggest" mode for hexagonal systems
Use <unorderd_set> instead of <set> for better performance

Fix

Fix a bug in the symmetrization of the Born effective charge

Assets 2