Input 03-xc.gga_x_ft97_a.inp

Commits > Commit 045d20dc05e1b42e239243cb04e8ce4d1aad770d > Run cuda-serial: [foss2022a-cuda-mpi]

Matches

Name Value Reference Precision Difference Status
gga_x_ft97_a Eigenvalue up -9.722530000000000e-01 -9.722925000000000e-01 4.340000000000000e-05 3.949999999997011e-05 PASS
gga_x_ft97_a Eigenvalue dn -8.267190000000000e-01 -8.267570000000000e-01 4.180000000000000e-05 3.799999999998249e-05 PASS
gga_x_ft97_a Exchange -3.290287400000000e-01 -3.290325100000000e-01 4.170000000000000e-06 3.770000000014040e-06 PASS
gga_x_ft97_a Int[n*v_xc] -4.093162600000000e-01 -4.093207200000000e-01 4.930000000000000e-06 4.459999999983921e-06 PASS
Compare to other inputs