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- 2014
- A mechanistic investigation of the manganese-salen epoxidation
- A hybrid configuration interaction treatment based on seniority number and excitation schemes
- Efficient description of strongly correlated electrons with mean-field cost
- Unraveling the mechanism of the manganese-salen epoxidation
- Assessing the quality of new quantum chemical methods by comparison with Full CI exchange-correlation holes
- The influence of orbital rotation on the energy of closed-shell wavefunctions
- Communication: DMRG-SCF study of the singlet, triplet, and quintet states of oxo-Mn(Salen)
- Nonvariational orbital optimization techniques for the AP1roG wave function
- DMRG-SCF study of the singlet, triplet, and quintet states of oxo-Mn(Salen)
- Simple and inexpensive perturbative correction schemes for antisymmetric products of nonorthogonal geminals