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Dear Gaussiaan users I have a file containing the xyz coordinates of a structure and i want to convert it into a gaussian input file gjf to open with Gaussview 5.0 ? Can someone help on this?
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I optimized 02 structures containing NO2 group by Gaussian at 6 311G (d,p) level. In the output file i observed that the NO2 is not connected to the structure and appears as O=N=O . Q1: When i...
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