Input 03-xc.gga_c_lm.inp
Commits >
Commit 3c86545dbb6a164adc7b03c9886fea0d0acfc59e >
Run GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
gga_c_lm Eigenvalue up (libxc5) | -5.902250000000000e-01 | -5.902250000000000e-01 | 8.250000000000000e-05 | 0.000000000000000e+00 | PASS |
gga_c_lm Eigenvalue dn (libxc5) | -6.503380000000000e-01 | -6.503380000000000e-01 | 6.160000000000001e-05 | 0.000000000000000e+00 | PASS |
gga_c_lm Correlation (libxc5) | -7.244304000000000e-02 | -7.244304000000000e-02 | 2.000000000000000e-06 | 0.000000000000000e+00 | PASS |
gga_c_lm Int[n*v_xc] (libxc5) | -6.834823000000000e-02 | -6.834823000000000e-02 | 1.600000000000000e-06 | 0.000000000000000e+00 | PASS |