Gaussian Tutorial (Lec-15) Mixed Basis Set in Gaussian 16 | GEN vs GENECP Explained
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Gaussian Tutorial (Lec-15) Mixed Basis Set in Gaussian 16 | GEN vs GENECP Explained
Ref: https://pubs.acs.org/doi/10.1021/acsapm.1c00902?ref=PDF In this tutorial on Gaussian 16, we explain the difference between GEN and GENECP keywords and how to write Gaussian input files using mixed basis sets. The video covers when to use GEN, when GENECP is required, and how effective core potentials (ECPs) are included for transition ...
232 views1 month ago
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