Comparison of algorithms for conical intersection optimisation using 
semiempirical methods

Keal, T. W.; Koslowski, A.; Thiel, W.

doi:10.1007/s00214-007-0331-5

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Comparison of algorithms for conical intersection optimisation using semiempirical methods

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Keal, T. W.
Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society;
Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society;

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Koslowski, A.
Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society;
Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society;

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Thiel, W.
Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society;
Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society;

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Keal, T. W., Koslowski, A., & Thiel, W. (2007). Comparison of algorithms for conical intersection optimisation using semiempirical methods. Theoretical Chemistry Accounts, 118, 837-844. doi:10.1007/s00214-007-0331-5.

Cite as: https://hdl.handle.net/11858/00-001M-0000-000F-911D-1

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