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85037325846
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Values of AR are obtained from an AIM analysis using the EXTREME program from Bader's AIMPAC package; cf. ref 15.
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15
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85037323009
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Note that this error margin is equal to the one estimated for Bader's integration method; cf. ref 9
-
Note that this error margin is equal to the one estimated for Bader's integration method; cf. ref 9.
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28
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36549099599
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Excellent correlations of even HF/4-21G* calculated CH bond length with isolated stretching frequencies have been reported: Snyder, R. G.; Aljibury, A. L.; Strauss, H. L.; Casal, H. L.; Gough, K. M.; Murphy, W. F. J. Chem. Phys. 1984,81,5352.
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85037306542
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