QMForge is a used program to check result of quantum chemistry (DFT) calculation. Gauss of 98/03, ADF, GAMESS (US), GAMESS (UK), PC-GAMESS, Jaguar, and file ORCA supported. The following analysis is be available:
- Overlap Population Analysis (OPA)
- Mulliken Population Analysis (MPA)
- C-squared Population Analysis (SCPA)
- Charge Decomposition Analysis (CDA)
- Mayer's Bond Orders
- Fragment Analysis
QMForge
Sunday, June 28, 2009
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