Match Hartree energy
Commits >
Commit 8f70c6ee77762d8b3d61df63beb761c1a94f9b18 >
Run intel_mpi_autotools: [intel2023a-mpi] >
Input 02-ACBN0.01-nio.inp
Value | Reference | Precision | Status |
8.788829191000001e+01 | 8.788829173000001e+01 | 1.410000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)