Releases: msg-byu/symlib
Releases · msg-byu/symlib
v2.0.2
This release keeps symlib compatible with the latest enumlib. A recent change in symlib and enumlib eliminates failure of enumlib when generating large derivative supercells. The problem was merely roundoff error in a 3x3 matrix inverse. Having the tolerance too tight (the default is 10d-14) in that inverse caused failures when it shouldn't have.
Enumlib Update Compatible
This version has some changes to make it compatible with the lastest changes in enumlib
. Some of the calling interfaces changed (mostly some pointer
variables were changed to allocatable
arrays.)
Release version of the msg symmetry library
This library has been in "release" shape for 2 decades but making it official.