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- Calculation of singlet states in Tamm-Dancoff approximation
- `Pure' and hybrid-DFT adiabatic XC kernel
- Solvers: Conjugate gradient and block Davidson (both with preconditioning)
- G-vector parallel
- Optimisations for -point
- Calculation checkpointing and restart
- Oscillator strengths (for computing spectra)
- Characterisation of eigenvectors by decomposing into KS orbitals
Dominik Jochym
2010-07-20