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TURBOMOLE V6.1 2009, a development of University of Karlsruhe and Forschungszentrum Karlsruhe GmbH, 1989 - 2007, TURBOMOLE GmbH, since 2007; available from
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We note however, that this is only a qualitative result since the accuracy needed for precise calculation of equilibrium constants for systems of this size is beyond the reach of our computational resources. Further computational details are given in the Supporting Information
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We note however, that this is only a qualitative result since the accuracy needed for precise calculation of equilibrium constants for systems of this size is beyond the reach of our computational resources. Further computational details are given in the Supporting Information.
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78649302839
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SCHAKAL 99, E. Keller, Albert-Ludwigs-Universitåt Freiburg, Germany
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SCHAKAL 99, E. Keller, Albert-Ludwigs-Universitåt Freiburg, Germany.
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