Molecular Orbital & Properties: How to Use freuency Viewer
manual version.
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Initial page. You can choose MOPAC or Gaussian. But Gaussian routine is not done yet. If many users want to use Gaussian, please feed back me. I will make that routine.
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Copy molecular structure part of MOPAC arc file.
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Paste (command-V) that molecular structure to Upper Text Area.
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Then Search Frequency part from MOPAC output file. Copy only frequency + blank line + frequency data.
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Then paste frequency to lower text Area and push Read button.
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Then you can see molecule. This program support MOPAC ver7, MOPAC ver97 for Mac. Please try and feed back me other system.
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If you choose B&S, you can see the frecuency with Ball&Stick model. |
Last Update 2003.10.18
Top page Frequency View of TS Edit TS Structure How to UseCheck Frequency How to use |
MOPAC Calculation Ab initio calculation Monte Carlo simulation Polymer properties estimation |