Match LDA Total Energy
Commits >
Commit 6186e1f92bb6a84e4a2e679736ea9db4d0c9eca5 >
Run spack_foss-2022a_cuda_serial >
Input 01-xc_1d.01-wfs-lda.inp
Value | Reference | Precision | Status |
-4.179651570000000e+00 | -4.179676910000000e+00 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)