Gaussian 16 Revision C.01
For technical support, visit the official Gaussian website or consult your local HPC administrator.
The default memory allocation is 800 MB, but users can request more using the gaussian 16 revision c.01
This revision refined the integration of , a tool for conformer searching. For a chemist, this is vital because properties aren't just based on one static structure, but on a "population" of shapes. C.01 makes it easier to find the global minimum energy structure. It also uses the GEDIIS optimizer, which converges difficult geometries much faster than older algorithms. 4. Harmonic and Anharmonic Analysis For technical support, visit the official Gaussian website
: Requires Linda 9.2; older versions of Linda are strictly incompatible with Rev. C.01 . Harmonic and Anharmonic Analysis : Requires Linda 9
Gaussian 16 Revision C.01, released by Gaussian, Inc. , is a major update to the world-renowned quantum chemistry software package [11, 22]. This revision introduced critical performance enhancements and hardware support that significantly expanded its computational capabilities. 1. Key Performance & Hardware Support A100 GPU Support:
Rev C.01 corrects an oscillator strength bug present in Rev A.02 for PCM/TD-DFT.