Tips and Tricks
Tips and Tricks
Tips and Tricks
- GAMESS: Quick Run with MPI method — Oct 12, 2018
- Gaussian: Make Energy Convergence in Optimization Easy ! — Jun 30, 2015
- Gaussian: Use B3LYP-VWN5 instead of B3LYP-VWN3 — Apr 4, 2017
- Partial Recompile NWChem — Nov 12, 2018
- Post-HF: How to Select Active Space Orbital and Active Electron for Post-HF — Dec 7, 2016
- Q-Chem: How to run Q-Chem without "$QC/bin/qchem" script — May 21, 2018