Input 14-libvdwxc_Be_hcp.01-vdwdfcx.inp
Commits >
Commit c9606f298ccf4e57d14167459d26815f7508aa3e >
Run foss_valgrind_autotools: [foss2023a-serial]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Total energy | -2.679161995000000e+01 | -2.679161998000000e+01 | 1.340000000000000e-07 | 2.999999537678377e-08 | PASS |
| Exchange energy | -3.827382340000000e+00 | -3.827382340000000e+00 | 1.910000000000000e-07 | 0.000000000000000e+00 | PASS |
| Correlation energy | -4.147289400000000e-01 | -4.147289400000000e-01 | 2.070000000000000e-07 | 0.000000000000000e+00 | PASS |