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Directory UMM :wiley:Public:journals:jcc:suppmat:18:

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0.0 10.0 20.0 t/ps

0.6 0.8 1.0 1.2

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Directory UMM :wiley:Public:journals:jcc:suppmat:18:

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Directory UMM :wiley:Public:journals:jcc:suppmat:18:

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Directory UMM :wiley:Public:journals:jcc:suppmat:18:

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Directory UMM :wiley:Public:journals:jcc:suppmat:18:

Uphill Energy Diff... Uphill

Directory UMM :wiley:Public:journals:jcc:suppmat:18:

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Directory UMM :wiley:Public:journals:jcc:suppmat:18:

(2) Table 4 : MP2 calculated positional charge densities (q in electronic unit) and dipole moment (  in Debye) for the direct tautomerization processes by NBO method.. Table 5 :

Directory UMM :wiley:Public:journals:jcc:suppmat:18:

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Directory UMM :wiley:Public:journals:jcc:suppmat:18:

[r]