Citation: Td. Poulsen et al., The combined multiconfigurational self-consistent-field/molecular mechanics wave function approach, J CHEM PHYS, 115(6), 2001, pp. 2393-2400
Citation: Td. Poulsen et al., A quantum mechanical method for calculating nonlinear optical properties of condensed phase molecules coupled to a molecular mechanics field: A quadratic multiconfigurational self-consistent-field/molecular mechanics response method, J CHEM PHYS, 115(17), 2001, pp. 7843-7851
Authors:
Keszthelyi, T
Poulsen, TD
Ogilby, PR
Mikkelsen, KV
Citation: T. Keszthelyi et al., O-2(a(1)Delta(g)) absorption and O-2(b(1)Sigma(+)(g)) emission in solution: Quantifying the a-b Stokes shift, J PHYS CH A, 104(45), 2000, pp. 10550-10555
Citation: L. Poulsen et Pr. Ogilby, Oxygen diffusion in glassy polymer films: Effects of other gases and changes in pressure, J PHYS CH A, 104(12), 2000, pp. 2573-2580
Citation: Td. Poulsen et al., The a(1)Delta(g) -> X-3 Sigma(-)(g) transition in molecular oxygen: Interpretation of solvent effects on spectral shifts, J PHYS CH A, 103(18), 1999, pp. 3418-3422
Authors:
Dam, N
Scurlock, RD
Wang, BJ
Ma, LC
Sundahl, M
Ogilby, PR
Citation: N. Dam et al., Singlet oxygen as a reactive intermediate in the photodegradation of phenylenevinylene oligomers, CHEM MATER, 11(5), 1999, pp. 1302-1305
Authors:
Keszthelyi, T
Weldon, D
Andersen, TN
Poulsen, TD
Mikkelsen, KV
Ogilby, PR
Citation: T. Keszthelyi et al., Radiative transitions of singlet oxygen: New tools, new techniques and newinterpretations, PHOTOCHEM P, 70(4), 1999, pp. 531-539
Citation: Td. Poulsen et al., Quadratic response of molecules in a nonequilibrium and equilibrium solvation model: Generalizations to include both singlet and triplet perturbations, J CHEM PHYS, 111(6), 1999, pp. 2678-2685
Citation: Td. Poulsen et al., Solvent effects on the O-2(a(1)Delta(g))-O-2(X-3 Sigma(-)(g)) radiative transition: Comments regarding charge-transfer interactions, J PHYS CH A, 102(48), 1998, pp. 9829-9832