Input 07-mgga.03-tb09_td.inp

Commits > Commit 119356330ffc33ec037b7259f31bc868121af1f1 > Run spack_intel-2022a_serial_omp

Matches

Name Value Reference Precision Difference Status
Energy [step 1] (libxc5) -4.657566324809309e+01 -4.647906570762484e+01 1.060000000000000e-01 -9.659754046824531e-02 PASS
Energy [step 5] (libxc5) -4.657612931583687e+01 -4.657612926021354e+01 6.120000000000001e-08 -5.562332461295227e-08 PASS
Energy [step 10] (libxc5) -4.657642748315619e+01 -4.657642785019272e+01 4.040000000000000e-07 3.670365273933385e-07 PASS
Energy [step 15] (libxc5) -4.657647547962340e+01 -4.657647517359855e+01 3.370000000000000e-07 -3.060248516817410e-07 PASS
Energy [step 20] (libxc5) -4.657643789745676e+01 -4.657643693274203e+01 1.060000000000000e-06 -9.647147223290631e-07 PASS
Vector potential [step 1] 1.000000000000000e+01 1.000000000000000e+01 1.000000000000000e-01 0.000000000000000e+00 PASS
Vector potential [step 5] (libxc5) 9.928666877230210e+00 9.928666877230210e+00 4.960000000000000e-13 0.000000000000000e+00 PASS
Vector potential [step 10] (libxc5) 9.721533213344554e+00 9.721533213344554e+00 9.720000000000000e-14 0.000000000000000e+00 PASS
Vector potential [step 15] (libxc5) 9.393406286839875e+00 9.393406286839873e+00 9.390000000000000e-14 1.776356839400250e-15 PASS
Vector potential [step 20] (libxc5) 8.957517424000038e+00 8.957517424000001e+00 4.480000000000000e-08 3.730349362740526e-14 PASS
Compare to other inputs