Input 04-tetragonal.43-spg117.inp

Commits > Commit 9c86d3f9e0672ab6f34186f0e6ca5b729d8f047e > Run intel-2022b

Matches

Name Value Reference Precision Difference Status
Space group 1.170000000000000e+02 1.170000000000000e+02 1.000000000000000e-04 0.000000000000000e+00 PASS
No. of symmetries 4.000000000000000e+00 4.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
S1 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
S2 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
S3 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
S4 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
Total k-points 6.400000000000000e+01 6.400000000000000e+01 1.000000000000000e-04 0.000000000000000e+00 PASS
Reduced k-points 1.800000000000000e+01 1.800000000000000e+01 1.000000000000000e-04 0.000000000000000e+00 PASS
kpt 1 1.560000000000000e-02 1.563000000000000e-02 1.000000000000000e-04 -3.000000000000225e-05 PASS
kpt 2 6.250000000000000e-02 6.250000000000000e-02 1.000000000000000e-04 0.000000000000000e+00 PASS
kpt 3 3.120000000000000e-02 3.125000000000000e-02 1.000000000000000e-04 -5.000000000000143e-05 PASS
kpt 4 6.250000000000000e-02 6.250000000000000e-02 1.000000000000000e-04 0.000000000000000e+00 PASS
kpt 5 6.250000000000000e-02 6.250000000000000e-02 1.000000000000000e-04 0.000000000000000e+00 PASS
kpt 6 1.560000000000000e-02 1.563000000000000e-02 1.000000000000000e-04 -3.000000000000225e-05 PASS
kpt 7 3.120000000000000e-02 3.125000000000000e-02 1.000000000000000e-04 -5.000000000000143e-05 PASS
kpt 8 1.250000000000000e-01 1.250000000000000e-01 1.000000000000000e-04 0.000000000000000e+00 PASS
kpt 9 6.250000000000000e-02 6.250000000000000e-02 1.000000000000000e-04 0.000000000000000e+00 PASS
kpt 10 1.250000000000000e-01 1.250000000000000e-01 1.000000000000000e-04 0.000000000000000e+00 PASS
kpt 11 1.250000000000000e-01 1.250000000000000e-01 1.000000000000000e-04 0.000000000000000e+00 PASS
kpt 12 3.120000000000000e-02 3.125000000000000e-02 1.000000000000000e-04 -5.000000000000143e-05 PASS
kpt 13 1.560000000000000e-02 1.563000000000000e-02 1.000000000000000e-04 -3.000000000000225e-05 PASS
kpt 14 6.250000000000000e-02 6.250000000000000e-02 1.000000000000000e-04 0.000000000000000e+00 PASS
kpt 15 3.120000000000000e-02 3.125000000000000e-02 1.000000000000000e-04 -5.000000000000143e-05 PASS
kpt 16 6.250000000000000e-02 6.250000000000000e-02 1.000000000000000e-04 0.000000000000000e+00 PASS
kpt 17 6.250000000000000e-02 6.250000000000000e-02 1.000000000000000e-04 0.000000000000000e+00 PASS
kpt 18 1.560000000000000e-02 1.563000000000000e-02 1.000000000000000e-04 -3.000000000000225e-05 PASS
Compare to other inputs