csv_tables_figs.tar.gz -- files of data used to construct each table and
figure in the paper, in csv, ods or dat format
inputs_script_nwchem.tar.gz -- NWCHEM input scripts for molecular test-set
calculations, including the G3, T82F and T96R
test sets. All data in NWCHEM input format *.nw
with molecule identified on first line of file.
inputs_script_vasp.tar.gz -- VASP input scripts for solids used in timing
and equation-of-state calculations.
inputs_script_md.tar.gz -- VASP input scripts for the AIMD simulation of Al