Utilities


Utility FreqGrab is intended for extract of vibration frequencies from an out-file of program Gaussian. The extracted values of frequencies, seat to a text file with frq extension which forms in a flowing directory.

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Utility Adex is intended for extract points profile of potential of rotation from an out-file of Gaussian. Extracted turn angle and potentials energies, seat in a text file with adx extension which forms in a flowing directory.

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Utility GeomMultiConverter is intended for mass converting the files containing geometry, in different formats.

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