Match comparison for Total Energy (match type 29227)
Commits >
Commit a02211b136400868a3f91e422c586cb9ab194975 >
Input 21-qedft-breit-3d.01-pxlda-hydrogen.inp
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
-4.404965900000000e-01 | 2.300000000000000e-07 | -4.404965900000000e-01 | 0.000000000000000e+00 | -4.404965900000000e-01 | 0.000000000000000e+00 | PASS |
Checks do not indicate problems with this match.
Loading plot...
Detailed information
Reference: -0.44049659, precision: 0.00000023Run | Value | Difference | Relative difference | Status |
foss-cmake-zen4: [foss2023a-serial, foss-full] | -4.404965900000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss-cmake-zen4: [foss2023a-serial, foss-min] | -4.404965900000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |