Match Hartree energy
Commits >
Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc >
Run intel-parallel-debug: [intel2023a-mpi] >
Input 10-vdw_d3_dna.01-gs_novdw.inp
Value | Reference | Precision | Status |
3.356150011300000e+02 | 3.356150011300000e+02 | 1.680000000000000e-08 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)