escape from scan-land; making More O'Ferrall–Jencks plots in Rowan; extending Fukui calculations to more levels of theory; managing large numbers of concurrent jobs
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2D Scans, More Fukui Options, & Max…
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escape from scan-land; making More O'Ferrall–Jencks plots in Rowan; extending Fukui calculations to more levels of theory; managing large numbers of concurrent jobs