Match Hartree energy
Commits >
Commit 2cbd57b62c972cb2ebea8f328fb20b62d521e0ac >
Run cmake_foss_2022a_full_serial >
Input 09-vdw_ts_sc.01-gs.inp
Value | Reference | Precision | Status |
5.016538032000000e+01 | 5.016538032000000e+01 | 2.510000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)