Releases v2.9.0
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Added
Analytical PCM Hessian
Density fitting UCCSD
A general driver for finite difference gradients and hessian
Improved
Assign default auxiliary basis for def2-mtzvp and def2-mtzvpp
Better initial guess for smearing
libxc interface for passing omega in composite functionals
The tolerance in geometry when identifying point group symmetry
Adjust PBC GDF eigenvalue decomposition accuracy
Special treatment in PBC GDF for dimension=0 systems
The density matrices computation performance of fci_dhf_slow
Fixes
Dimension bug in spinor X2C code
C-PCM and SS(V)PE gradients
Complex density matrices for DFHF
Fixes COSMO-RS functionality
DF auxiliary basis assignment for ghost atoms
Lattice sum range issue for low-dimensional systems
The precision when dumping molecular geometry in fromfile/fromstring function
kpts_band in the rsdf method.
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