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Resources.j.bozzelli.2017
From NJIT-ARCS HPC Wiki
IST (Information Services and Technology) Resources Used in This Research
Hardware Employed | Existing Software Employed | New Software Requested/Employed | HPC Wiki Documentation Used | Consultation w/ARCS | Other |
---|---|---|---|---|---|
Kong; bozzelli short, medium, and long queues | Gaussian 09, NWChem | Future : new versions of Gaussian; a second calculation program named Orca; a third program for calculation of kinetics named Variflex | Extensively, especially "Running Jobs" and "Software" | Extensive, especially on submit scripts, and other scripts for post-processing and installation of programs |