Input 07-mgga.03-tb09_td.inp
Matches
Name | Value | Reference | Precision | Difference | Status |
Energy [step 1] (libxc5) | -4.638246816715382e+01 | -4.647906570762484e+01 | 1.060000000000000e-01 | 9.659754047101643e-02 | PASS |
Energy [step 5] (libxc5) | -4.657612920458745e+01 | -4.657612926021354e+01 | 6.120000000000001e-08 | 5.562609572962174e-08 | PASS |
Energy [step 10] (libxc5) | -4.657642821722993e+01 | -4.657642785019272e+01 | 4.040000000000000e-07 | -3.670372095143648e-07 | PASS |
Energy [step 15] (libxc5) | -4.657647486757097e+01 | -4.657647517359855e+01 | 3.370000000000000e-07 | 3.060275872712737e-07 | PASS |
Energy [step 20] (libxc5) | -4.657643596802454e+01 | -4.657643693274203e+01 | 1.060000000000000e-06 | 9.647174934457325e-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 |