S. Larsen, T. Thorsteinsson, S. Bøwadt, T. K. Hansen, K. S. Varma, J. Becher and A. E. Underhill.
Acta Chem. Scand. 45, 709-715 (1991).
Read more The Crystal Structures of Three Precursors to Organic Donors based on BEDT-TTF.
T. Thorsteinsson and S. Rettrup.
Adv. Quant. Chem. 31, 267-282 (1998).
T. Thorsteinsson and D. L. Cooper.
Int. J. Quant. Chem. 70, 637-650 (1998).
Read more Modern Valence Bond Descriptions of Molecular Excited States: An Application of CASVB.
D. L. Cooper, T. Thorsteinsson and J. Gerratt.
Adv. Quant. Chem. 32, 51-67 (1998).
T. Thorsteinsson and D. L. Cooper.
Mol. Phys. 93, 663-674 (1998).
Read more The biorthogonal method for optimizing modern valence bond wavefunctions.
P. Palmieri, A. O. Mitrushenkov, R. Tarroni and T. Thorsteinsson.
J. Chem. Soc. Faraday Trans. 94, 3061-3066 (1998).
T. Thorsteinsson, A. Famulari and M. Raimondi.
Int. J. Quant. Chem. 74, 231 (1999).
T. Thorsteinsson and D. L. Cooper.
In: “Quantum Systems in Chemistry and Physics. Volume 1: Basic problems and models systems” ed. A. Hernández-Laguna, J. Maruani, R. McWeeny and S. Wilson (Kluwer, Dordrecht); 303-26 (2000).
Read more An Overview of the CASVB Approach to Modern Valence Bond Calculations.
P. B. Karadakov, D. L. Cooper, T. Thorsteinsson and J. Gerratt.
In: “Quantum Systems in Chemistry and Physics. Volume 1: Basic problems and models systems” ed. A. Hernández-Laguna, J. Maruani, R. McWeeny and S. Wilson (Kluwer, Dordrecht); 327-44 (2000).
Read more Modern Valence-Bond Description of the Mechanisms of Six-Electron Pericyclic Reactions.
T. Thorsteinsson and D. L. Cooper.
J. Math. Chem. 23, 105-126 (1998).
Has also appeared as: A new approach to valence bond calculations: CASVB.
T. Thorsteinsson, D. L. Cooper, J. Gerratt and M. Raimondi.
Read more A new approach to valence bond calculations: CASVB.
S. Rettrup, T. Thorsteinsson and C. R. Sarma.
Int. J. Quant. Chem. 40, 709-717 (1991).
D. L. Cooper, J. Gerratt, M. Raimondi, M. Sironi and T. Thorsteinsson.
Theor. Chim. Acta 85, 261-270 (1993).
Read more Expansion of the spin-coupled wavefunction in Slater determinants.
D. L. Cooper, R. Ponec, T. Thorsteinsson and G. Raos.
Int. J. Quant. Chem. 57, 501-518 (1996).
D. L. Cooper, T. Thorsteinsson, M. Raimondi and J. Gerratt.
Phil. Mag. B 73, 175-179 (1996).
Read more A modern valence bond approach for interatomic potentials.
T. Thorsteinsson, D. L. Cooper, J. Gerratt, P. B. Karadakov and M. Raimondi.
Theor. Chim. Acta 93, 343-366 (1996).
Read more Modern valence bond representations of CASSCF wavefunctions.
T. Thorsteinsson and D. L. Cooper.
Theor. Chim. Acta 94, 233-245 (1996).
T. Thorsteinsson, D. L. Cooper, J. Gerratt and M. Raimondi.
Theor. Chim. Acta 95, 131-150 (1997).
D. L. Cooper, T. Thorsteinsson and J. Gerratt.
Int. J. Quant. Chem. 65, 439-451 (1997).
Read more Fully-variational optimization of modern VB wave functions using the CASVB strategy.
M. Østergaard Jensen, T. Thorsteinsson and Aa. E. Hansen.
Int. J. Quant. Chem. 90, 616-28 (2002).
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