Releases: MolSSI/QCEngine
Releases · MolSSI/QCEngine
v0.3.0
v0.2.1
v0.2.0 release
Notes:
- Added automatic memory and thread parameterization through
auto
flags. - Adds support for Psi4 v1.1, v1.2rc2
- Updates JSON support to v1 of the QC Schema.
Notes:
auto
flags.