Gaussian 16 Revision C.01 Today
This revision supports a wide range of architectures, including x86_64, IA32, Power, and ARM on Linux, AIX, and macOS [10]. Parallel Computing: It utilizes the
Gaussian 16 Revision C.01 retains the full breadth of advanced quantum mechanics methods characteristic of the suite: Molecular Mechanics & Semi-Empirical Methods
For researchers, the correct citation for this specific software version is: gaussian 16 revision c.01
Supports a vast array of functionals, including hybrid (B3LYP, PBE0), range-separated (M06-2X,
Revision C.01 inherits and refines the core functionalities that make Gaussian 16 a powerhouse: This revision supports a wide range of architectures,
and derivatives for overlap and the core Hamiltonian. Atomic populations and property operator matrices.
Other specific bug fixes include a patch for building the C-code with the pgcc compiler and fixes for script shebangs. However, some minor issues persist. One known quirk in Revision C.01 is its tendency to generate an unneeded fort.7 file in the working directory. While this file does not harm the calculation results or affect their accuracy, it can be an annoyance for users who prefer a clean directory. The recommended workaround to prevent this file from being generated is to add the directive IOp(99/10=0) to the route section of the input file. Other specific bug fixes include a patch for
Predicting IR, Raman, NMR, and UV-Vis spectra.
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