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Working from home
Computational Chemist,
Guitarist,
Programmer,
but more than anything, music lover.
-
Universidad de Guanajuato
- Guanajuato, Gto.
- https://www.privateinvestigatoragencyofmolecules-mexico.com/
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TDSpectrum
TDSpectrum PublicPlots a UV-Vis spectrum from a gaussian output or saves only the data.
Python
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Scripts4Gaussian
Scripts4Gaussian PublicGets the xyz coordinates from last xyz coordinates in the gaussian output file.
Shell
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TNBO7
TNBO7 PublicTransforms the cartesian coordinates of the gaussian NBO7 output to a cartesian coordinates that chemcraft can read.
Python
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