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58. A.A. Golubeva, A.V. Nemukhin, S.J. Klippenstein, L.B. Harding, and A.I. Krylov Performance of the spin-flip and multi-reference methods for
bond-breaking in hydrocarbons: A benchmark study J. Phys. Chem. A 111, 13264 – 13271
(2007)
Abstract
PDF (162 kB)
57. P. A. Pieniazek, S. A. Arnstein, S. E. Bradforth, A. I. Krylov, and C. D. Sherrill Benchmark full configuration interaction and EOM-IP-CCSD
results for prototypical charge transfer systems: Noncovalent ionized dimers J. Chem. Phys. 127, 164110
(2007)
Abstract
PDF (1542 kB)
54. P. A. Pieniazek, A. I. Krylov, and S. E. Bradforth Electronic structure of the benzene dimer cation J. Chem. Phys. 127, 044317
(2007)
Abstract
PDF (981 kB)
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