← Back to context Comment by doctorpangloss 6 hours ago I suppose anyone can run the same computer simulations. 1 comment doctorpangloss Reply iliatoli 6 hours ago Yes — the input files, level of theory, and software (ORCA 6.1.1, free for academics) are all specified in the paper. The calculations are fully reproducible.
iliatoli 6 hours ago Yes — the input files, level of theory, and software (ORCA 6.1.1, free for academics) are all specified in the paper. The calculations are fully reproducible.
Yes — the input files, level of theory, and software (ORCA 6.1.1, free for academics) are all specified in the paper. The calculations are fully reproducible.