Input 03-xc.gga_x_dk87_r2.inp

Commits > Commit c7ac96946c926bee5c46ca4221093c1f60753f5a > Run spack_foss-2022a_cuda_mpi_omp

Matches

Name Value Reference Precision Difference Status
gga_x_dk87_r2 Eigenvalue up -9.703380000000000e-01 -9.703780000000000e-01 4.400000000000000e-05 3.999999999992898e-05 PASS
gga_x_dk87_r2 Eigenvalue dn -8.182030000000000e-01 -8.182410000000000e-01 4.180000000000000e-05 3.799999999998249e-05 PASS
gga_x_dk87_r2 Exchange -3.200668900000000e-01 -3.200705250000000e-01 4.000000000000000e-06 3.635000000001831e-06 PASS
gga_x_dk87_r2 Int[n*v_xc] -4.060814700000000e-01 -4.060859600000000e-01 4.940000000000000e-06 4.489999999968131e-06 PASS
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