Revision as of 12:01, 24 March 2010 by Sdonald(talk | contribs)(New page: go back to Scripts * Script to extract basic information about a gaussian job, like basis/method, symmetry, SCF energies, Convergence, Frequency info, No. of Negative eigenvalues etc....)
Script to extract basic information about a gaussian job, like basis/method, symmetry, SCF energies, Convergence, Frequency info, No. of Negative eigenvalues etc. si