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- Unrestricted Hartree-Fock
- MP2 via a very basic (and slow) implementation
- Full-CI via
- Many incompatible API changes
- Format of the
hdf5images has changed
- Some derived properties can be computed easily in python
(e.g. some energies or the virial ratio)
Redesign of the testing framework
- Extension and redesign of the python tests via the
- Continuous integration via Travis CI.
A note about the versioning
Since this is a project at a very early stage, we do not follow any versioning convention at the moment.
In other words it may well happen that this version and all future versions are entirely incompatible.