Input 03-xc.gga_x_am05.inp

Commits > Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc > Run foss-min-parallel: [foss2022a-mpi]

Matches

Name Value Reference Precision Difference Status
gga_x_am05 Eigenvalue up -9.369670000000000e-01 -9.369275000000000e-01 4.340000000000000e-05 -3.949999999997011e-05 PASS
gga_x_am05 Eigenvalue dn -7.872479999999999e-01 -7.872120000000000e-01 3.960000000000000e-05 -3.599999999992498e-05 PASS
gga_x_am05 Exchange -2.877501800000000e-01 -2.877471600000000e-01 3.320000000000000e-06 -3.020000000020229e-06 PASS
gga_x_am05 Int[n*v_xc] -3.731238200000000e-01 -3.731200150000000e-01 4.190000000000000e-06 -3.804999999967862e-06 PASS
Compare to other inputs