Input 03-xc.gga_x_rpbe.inp

Commits > Commit 119356330ffc33ec037b7259f31bc868121af1f1 > Run spack_foss-2022a_cuda_mpi_omp

Matches

Name Value Reference Precision Difference Status
gga_x_rpbe Eigenvalue up -9.728920000000000e-01 -9.729315000000001e-01 4.350000000000000e-05 3.950000000008114e-05 PASS
gga_x_rpbe Eigenvalue dn -8.239220000000000e-01 -8.239600000000000e-01 4.180000000000000e-05 3.799999999998249e-05 PASS
gga_x_rpbe Exchange -3.244972700000000e-01 -3.245010100000000e-01 4.120000000000000e-06 3.739999999974319e-06 PASS
gga_x_rpbe Int[n*v_xc] -4.092678600000000e-01 -4.092723600000000e-01 4.960000000000000e-06 4.500000000018378e-06 PASS
Compare to other inputs