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ncpchem:molecules_re_2010_01a [2025/01/11 03:30] 4.227.36.68 old revision restored (2024/09/19 02:31) |
ncpchem:molecules_re_2010_01a [2025/03/08 18:17] (current) 111.225.149.46 old revision restored (2024/12/24 08:14) |
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- | Working title: re_2010_01a | + | ===== Working title: re_2010_01a |
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- | <file re_2010_01a.xyz> | + | ===== B3LYP equilibrium structure ===== |
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+ | ===== B3LYP simulated IR spectrum ===== |