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ncpchem:molecules_re_2010_01a [2025/04/22 14:10] 47.128.23.15 old revision restored (2024/10/23 11:04) |
ncpchem:molecules_re_2010_01a [2025/04/27 12:02] (current) 47.128.99.220 old revision restored (2025/03/06 22:01) |
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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 ===== | ||
+ | {{: |