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2-Thiouracil deactivation pathways and triplet states population

João Paulo Gobbo, Antonio Carlos Borin

Computational and Theoretical Chemistry · 2014 · 58 citations · 42 references

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References

42

Second-order perturbation theory with a complete active space self-consistent field reference function

Kerstin Andersson, Per‐Åke Malmqvist, Björn O. Roos · The Journal of Chemical Physics · 1992 · 3.9K citations

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Second-order perturbation theory with a CASSCF reference function

Kerstin Andersson, Per Aake. Malmqvist, Bjoern O. Roos et al. · The Journal of Physical Chemistry · 1990 · 3.3K citations

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Characterization of electronic transitions in complex molecules

Michael Kasha · Discussions of the Faraday Society · 1950 · 2.8K citations

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Density matrix averaged atomic natural orbital (ANO) basis sets for correlated molecular wave functions

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MOLCAS 7: The Next Generation

Francesco Aquilante, Luca De Vico, Nicolas Ferré et al. · Journal of Computational Chemistry · 2009 · 1.5K citations

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