Quantum Chemistry With Python

The files used for workshop series: Quantum chemistry calculations with python

Recordings

Name		Name	Last commit message	Last commit date
Latest commit History 13 Commits
DFT_basics_SCF,_OPT,_Freq.ipynb		DFT_basics_SCF,_OPT,_Freq.ipynb
DFT_for_computing_molecular_properties.ipynb		DFT_for_computing_molecular_properties.ipynb
Input_structure_for_QC_calculations.ipynb		Input_structure_for_QC_calculations.ipynb
Multiple_molecules_optimization.ipynb		Multiple_molecules_optimization.ipynb
README.md		README.md