Gaussian 16 Revision C.01 ((top)) Jun 2026

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More robust calculations for VCD and ROA. gaussian 16 revision c.01

Gaussian has been slowly integrating GPU support, and Revision C.01 expanded this significantly. To help me give you the most relevant

: Increase the %mem value, or reduce the basis set size or the complexity of the correlation method (e.g., swapping CCSD(T) for a double-hybrid DFT functional). (often abbreviated as G16 Rev C

(often abbreviated as G16 Rev C.01) represents a significant milestone in the Gaussian 16 series. Released as an evolutionary update to earlier revisions (such as Rev A.03 and Rev B.01), Rev C.01 consolidates improvements in accuracy, parallel efficiency, and numerical stability. For research groups and high-performance computing (HPC) centers, understanding what this specific revision offers is critical for reproducibility, job optimization, and leveraging the latest methodological advancements.

Specify multiple scratch volumes using %RWF= or switch to a direct SCF method. Performance Optimization Best Practices

Gaussian 16 Revision C.01, released by Gaussian, Inc., is a specialized update to the core Gaussian 16 package that maintains broad compatibility across various high-performance computing (HPC) architectures. Core Platform Support