Input 03-xc.gga_x_xpbe.inp

Commits > Commit 7a2cd2a0801cf0c9aaf759ff5aac90b0fe91b5f6 > Run spack_foss-2022a_cuda_mpi_omp

Matches

Name Value Reference Precision Difference Status
gga_x_xpbe Eigenvalue up -9.711060000000000e-01 -9.711455000000000e-01 4.340000000000000e-05 3.949999999997011e-05 PASS
gga_x_xpbe Eigenvalue dn -8.198750000000000e-01 -8.199130000000000e-01 4.180000000000000e-05 3.799999999998249e-05 PASS
gga_x_xpbe Exchange -3.207233100000000e-01 -3.207269800000000e-01 4.040000000000000e-06 3.670000000011164e-06 PASS
gga_x_xpbe Int[n*v_xc] -4.070299400000000e-01 -4.070344200000000e-01 4.930000000000000e-06 4.480000000028905e-06 PASS
Compare to other inputs