Advances in Quantum Chemistry

Preface (J. Olsen et al.).Jan Linderberg, Scientist, Teacher, Friend (Y. Öhrn). Poul Jorgensen and his science (J. Oddershede). Multi-photon absorption of molecules (P. Cronstad et al.).Two-bond spin-spin coupling constants (^2hJX-Y) across X-H-Y hydrogen bonds: Some fundamental questions (J. Del Bene, J. Elguero). Structure optimizations for excited states with correlated second-order methods: CC2 and ADC(2) (Dr. C. Hättig).Angular symmetry and Hylleraas coordinates in four-body problems (F. Harris). The rotational g tensor as a benchmark for ab initio molecular property calculations (C.E. Mohn et al.).Linear response properties required to simulate vibrational spectra of biomolecules in various media: (R)-Phenyloxirane (A comparative theoretical and spectroscopic vibrational study)(K.J. Jalkanen et al.).A theoretical model to calculate fundamental physical parameters for molecule-particle interactions (A. Gross, K.V. Mikkelsen). Birefringences: A challenge for both theory and experiment (A. Rizzo, S. Coriani). The ab initio calculation of optical rotation and electronic circular dichroism (M. Pecul, K. Ruud). Response of a molecule to adding or removing an electron (J. Simons).A non-iterative numerical solver of Poisson and Helmholtz equations using high-order finite-element functions (R.J.F. Berger, D. Sundholm).Some trends in relativistic and electron correlation effects in electric properties of small molecules (M. Urban, V. Kellö).Restricted density functional response theory for open-shell systems (Z. Rinkevicius et al.).The multiconfigurational spin-tensor electron propagator method (MCSTEP)(D. Yeager).