Gaussian 16 Revision C.01 Work Access
: Resolved a recurring issue in anharmonic IR and Raman spectra calculations (Freq=Anharmonic) when using multiple incident light frequencies .
: Starting with Revision C.01, Linda 9.2 is required for network parallel processing; older versions are incompatible.
Accurate treatment of heavy elements using Effective Core Potentials (ECP). Why Upgrade to Revision C.01? gaussian 16 revision c.01
Gaussian Inc. provides a range of support and resources for users of Gaussian 16 Revision C.01, including:
Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Scalmani, G.; Barone, V.; Petersson, G. A.; Nakatsuji, H. et al. , Gaussian, Inc., Wallingford CT, 2016. 2 requirements for this revision? Citation - Gaussian.com : Resolved a recurring issue in anharmonic IR
Here is a concise breakdown of the key points that make C.01 significant: 1. Enhanced Performance for Large Molecules
g16 < /dev/null | grep "Revision"
Mick Philpott’s Blog (and similar computational chemistry blogs) Topic: Comparing Gaussian 16 C.01 to ORCA 5.0