Concepedia

Computational investigation of the photochemical deoxygenation of thiophene- S-oxide and selenophene- Se-oxide

Stacey A. Stoffregen, Stephanie Y. Lee, Pearl Dickerson, William S. Jenks

Photochemical & Photobiological Sciences · 2014 · 14 citations · 47 references

DOI

Concepts

References

47

General atomic and molecular electronic structure system

Michael W. Schmidt, Kim K. Baldridge, Jerry A. Boatz et al. · Journal of Computational Chemistry · 1993 · 20.2K citations

, , +17

Gaussian-3 (G3) theory for molecules containing first and second-row atoms

Larry A. Curtiss, Krishnan Raghavachari, Paul C. Redfern et al. · The Journal of Chemical Physics · 1998 · 2.9K citations

, , +10

Macmolplt: a graphical user interface for GAMESS

Brett Bode, Mark S. Gordon · Journal of Molecular Graphics and Modelling · 1998 · 1.1K citations

, , +12

Quasidegenerate perturbation theory with multiconfigurational self-consistent-field reference functions

Haruyuki Nakano · The Journal of Chemical Physics · 1993 · 929 citations

, , +16

MCSCF reference quasidegenerate perturbation theory with Epstein—Nesbet partitioning

Haruyuki Nakano · Chemical Physics Letters · 1993 · 291 citations

, , +2