Input 30-stress.02-gamma_point.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Pressure (H/b^3) |
5.662478940000000e-04 |
5.662478850000000e-04 |
2.830000000000000e-11 |
8.999999964037775e-12 |
PASS |
| Pressure (GPa) |
1.665959427000000e+01 |
1.665959420000000e+01 |
8.330000000000000e-07 |
6.999999868639861e-08 |
PASS |
| Kinetic stress (11) |
9.361438596999999e-03 |
9.361438596000001e-03 |
4.680000000000000e-11 |
9.999986949615902e-13 |
PASS |
| Kinetic stress (12) |
-3.885780586000000e-19 |
-1.577266095000000e-15 |
1.740000000000000e-15 |
1.576877516941400e-15 |
PASS |
| Kinetic stress (13) |
0.000000000000000e+00 |
-8.541147970000002e-16 |
5.350000000000000e-15 |
8.541147970000002e-16 |
PASS |
| Kinetic stress (21) |
-3.885780586000000e-19 |
-1.577266095000000e-15 |
1.740000000000000e-15 |
1.576877516941400e-15 |
PASS |
| Kinetic stress (22) |
9.361438598000000e-03 |
9.361438596000001e-03 |
4.680000000000000e-11 |
1.999999124646656e-12 |
PASS |
| Kinetic stress (23) |
1.526556659000000e-18 |
-4.920391895000000e-16 |
6.550000000000000e-15 |
4.935657461590000e-16 |
PASS |
| Kinetic stress (31) |
0.000000000000000e+00 |
-8.541147970000002e-16 |
5.350000000000000e-15 |
8.541147970000002e-16 |
PASS |
| Kinetic stress (32) |
1.526556659000000e-18 |
-4.920391895000000e-16 |
6.550000000000000e-15 |
4.935657461590000e-16 |
PASS |
| Kinetic stress (33) |
9.361438598000000e-03 |
9.361438596000001e-03 |
4.680000000000000e-11 |
1.999999124646656e-12 |
PASS |
| Hartree stress (11) |
8.859962931000000e-04 |
8.859962924000001e-04 |
4.430000000000000e-12 |
6.999999538348511e-13 |
PASS |
| Hartree stress (12) |
-2.125891584000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-2.125891584000000e-20 |
PASS |
| Hartree stress (13) |
1.490885007000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.490885007000000e-20 |
PASS |
| Hartree stress (21) |
-2.125891584000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-2.125891584000000e-20 |
PASS |
| Hartree stress (22) |
8.859962931000000e-04 |
8.859962924000001e-04 |
4.430000000000000e-12 |
6.999999538348511e-13 |
PASS |
| Hartree stress (23) |
1.684147878000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.684147878000000e-20 |
PASS |
| Hartree stress (31) |
1.490885007000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.490885007000000e-20 |
PASS |
| Hartree stress (32) |
1.684147878000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.684147878000000e-20 |
PASS |
| Hartree stress (33) |
8.859962931000000e-04 |
8.859962924000001e-04 |
4.430000000000000e-12 |
6.999999538348511e-13 |
PASS |
| XC stress (11) |
-3.734425480000000e-03 |
-3.734425480000000e-03 |
1.870000000000000e-10 |
0.000000000000000e+00 |
PASS |
| XC stress (12) |
2.251328871000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
2.251328871000000e-20 |
PASS |
| XC stress (13) |
-8.711733862999999e-21 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-8.711733862999999e-21 |
PASS |
| XC stress (21) |
2.251328871000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
2.251328871000000e-20 |
PASS |
| XC stress (22) |
-3.734425480000000e-03 |
-3.734425480000000e-03 |
1.870000000000000e-10 |
0.000000000000000e+00 |
PASS |
| XC stress (23) |
-3.385590690000000e-21 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-3.385590690000000e-21 |
PASS |
| XC stress (31) |
-8.711733862999999e-21 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-8.711733862999999e-21 |
PASS |
| XC stress (32) |
-3.385590690000000e-21 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-3.385590690000000e-21 |
PASS |
| XC stress (33) |
-3.734425480000000e-03 |
-3.734425480000000e-03 |
1.870000000000000e-10 |
0.000000000000000e+00 |
PASS |
| Ion-ion stress (11) |
-1.149183583000000e-02 |
-1.149183583000000e-02 |
5.750000000000000e-11 |
0.000000000000000e+00 |
PASS |
| Ion-ion stress (12) |
-4.523568278000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-4.523568278000000e-19 |
PASS |
| Ion-ion stress (13) |
8.918692209000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
8.918692209000000e-20 |
PASS |
| Ion-ion stress (21) |
-4.523568807000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-4.523568807000000e-19 |
PASS |
| Ion-ion stress (22) |
-1.149183583000000e-02 |
-1.149183583000000e-02 |
5.750000000000000e-11 |
0.000000000000000e+00 |
PASS |
| Ion-ion stress (23) |
8.963465368000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
8.963465368000000e-20 |
PASS |
| Ion-ion stress (31) |
8.918689560000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
8.918689560000000e-20 |
PASS |
| Ion-ion stress (32) |
8.963464045000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
8.963464045000000e-20 |
PASS |
| Ion-ion stress (33) |
-1.149183583000000e-02 |
-1.149183583000000e-02 |
5.750000000000000e-11 |
0.000000000000000e+00 |
PASS |
| Stress (11) |
-5.662478932000000e-04 |
-5.662478856000000e-04 |
8.850000000000000e-12 |
-7.600000056368073e-12 |
PASS |
| Stress (12) |
9.188935928000000e-19 |
9.677328992000001e-16 |
1.060000000000000e-15 |
-9.668140056072001e-16 |
PASS |
| Stress (13) |
-1.266594019000000e-19 |
1.702185288000000e-15 |
1.030000000000000e-14 |
-1.702311947401900e-15 |
PASS |
| Stress (21) |
9.188936458000001e-19 |
9.677329061999999e-16 |
1.060000000000000e-15 |
-9.668140125542000e-16 |
PASS |
| Stress (22) |
-5.662478937000000e-04 |
-5.662478852000001e-04 |
9.570000000000001e-12 |
-8.499999966035676e-12 |
PASS |
| Stress (23) |
-2.032413805000000e-18 |
1.173998455000000e-15 |
1.270000000000000e-14 |
-1.176030868805000e-15 |
PASS |
| Stress (31) |
-1.266593754000000e-19 |
1.702185288000000e-15 |
1.030000000000000e-14 |
-1.702311947375400e-15 |
PASS |
| Stress (32) |
-2.032413792000000e-18 |
1.173998455000000e-15 |
1.270000000000000e-14 |
-1.176030868792000e-15 |
PASS |
| Stress (33) |
-5.662478936000000e-04 |
-5.662478851000000e-04 |
9.680000000000001e-12 |
-8.499999966035676e-12 |
PASS |