Input 30-stress.02-gamma_point.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Pressure (H/b^3) |
5.662478910000000e-04 |
5.662478850000000e-04 |
2.830000000000000e-11 |
5.999999976025183e-12 |
PASS |
| Pressure (GPa) |
1.665959419000000e+01 |
1.665959420000000e+01 |
8.330000000000000e-07 |
-1.000000082740371e-08 |
PASS |
| Kinetic stress (11) |
9.361438595000000e-03 |
9.361438596000001e-03 |
4.680000000000000e-11 |
-1.000000429685066e-12 |
PASS |
| Kinetic stress (12) |
-9.992007222000000e-19 |
-1.577266095000000e-15 |
1.740000000000000e-15 |
1.576266894277800e-15 |
PASS |
| Kinetic stress (13) |
1.137978600000000e-18 |
-8.541147970000002e-16 |
5.350000000000000e-15 |
8.552527756000001e-16 |
PASS |
| Kinetic stress (21) |
-9.992007222000000e-19 |
-1.577266095000000e-15 |
1.740000000000000e-15 |
1.576266894277800e-15 |
PASS |
| Kinetic stress (22) |
9.361438595000000e-03 |
9.361438596000001e-03 |
4.680000000000000e-11 |
-1.000000429685066e-12 |
PASS |
| Kinetic stress (23) |
-8.881784197000001e-19 |
-4.920391895000000e-16 |
6.550000000000000e-15 |
4.911510110803000e-16 |
PASS |
| Kinetic stress (31) |
1.137978600000000e-18 |
-8.541147970000002e-16 |
5.350000000000000e-15 |
8.552527756000001e-16 |
PASS |
| Kinetic stress (32) |
-8.881784197000001e-19 |
-4.920391895000000e-16 |
6.550000000000000e-15 |
4.911510110803000e-16 |
PASS |
| Kinetic stress (33) |
9.361438595000000e-03 |
9.361438596000001e-03 |
4.680000000000000e-11 |
-1.000000429685066e-12 |
PASS |
| Hartree stress (11) |
8.859962916000000e-04 |
8.859962924000001e-04 |
4.430000000000000e-12 |
-8.000000401714447e-13 |
PASS |
| Hartree stress (12) |
2.013452285000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
2.013452285000000e-20 |
PASS |
| Hartree stress (13) |
-3.070934524000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-3.070934524000000e-20 |
PASS |
| Hartree stress (21) |
2.013452285000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
2.013452285000000e-20 |
PASS |
| Hartree stress (22) |
8.859962916000000e-04 |
8.859962924000001e-04 |
4.430000000000000e-12 |
-8.000000401714447e-13 |
PASS |
| Hartree stress (23) |
1.070412717000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.070412717000000e-20 |
PASS |
| Hartree stress (31) |
-3.070934524000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-3.070934524000000e-20 |
PASS |
| Hartree stress (32) |
1.070412717000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.070412717000000e-20 |
PASS |
| Hartree stress (33) |
8.859962916000000e-04 |
8.859962924000001e-04 |
4.430000000000000e-12 |
-8.000000401714447e-13 |
PASS |
| XC stress (11) |
-3.734425479000000e-03 |
-3.734425480000000e-03 |
1.870000000000000e-10 |
9.999999960041972e-13 |
PASS |
| XC stress (12) |
-2.729857419000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-2.729857419000000e-20 |
PASS |
| XC stress (13) |
-2.382912723000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-2.382912723000000e-20 |
PASS |
| XC stress (21) |
-2.729857419000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-2.729857419000000e-20 |
PASS |
| XC stress (22) |
-3.734425479000000e-03 |
-3.734425480000000e-03 |
1.870000000000000e-10 |
9.999999960041972e-13 |
PASS |
| XC stress (23) |
3.252633671000000e-21 |
0.000000000000000e+00 |
1.000000000000000e-15 |
3.252633671000000e-21 |
PASS |
| XC stress (31) |
-2.382912723000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-2.382912723000000e-20 |
PASS |
| XC stress (32) |
3.252633671000000e-21 |
0.000000000000000e+00 |
1.000000000000000e-15 |
3.252633671000000e-21 |
PASS |
| XC stress (33) |
-3.734425479000000e-03 |
-3.734425480000000e-03 |
1.870000000000000e-10 |
9.999999960041972e-13 |
PASS |
| Ion-ion stress (11) |
-1.149183583000000e-02 |
-1.149183583000000e-02 |
5.750000000000000e-11 |
0.000000000000000e+00 |
PASS |
| Ion-ion stress (12) |
-5.387728891000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-5.387728891000000e-19 |
PASS |
| Ion-ion stress (13) |
1.094548984000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.094548984000000e-19 |
PASS |
| Ion-ion stress (21) |
-5.387728891000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-5.387728891000000e-19 |
PASS |
| Ion-ion stress (22) |
-1.149183583000000e-02 |
-1.149183583000000e-02 |
5.750000000000000e-11 |
0.000000000000000e+00 |
PASS |
| Ion-ion stress (23) |
-4.706841641000000e-22 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-4.706841641000000e-22 |
PASS |
| Ion-ion stress (31) |
1.094548984000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.094548984000000e-19 |
PASS |
| Ion-ion stress (32) |
-4.706841641000000e-22 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-4.706841641000000e-22 |
PASS |
| Ion-ion stress (33) |
-1.149183583000000e-02 |
-1.149183583000000e-02 |
5.750000000000000e-11 |
0.000000000000000e+00 |
PASS |
| Stress (11) |
-5.662478908000000e-04 |
-5.662478856000000e-04 |
8.850000000000000e-12 |
-5.200000044273956e-12 |
PASS |
| Stress (12) |
2.041423591000000e-18 |
9.677328992000001e-16 |
1.060000000000000e-15 |
-9.656914756090001e-16 |
PASS |
| Stress (13) |
-1.100938398000000e-18 |
1.702185288000000e-15 |
1.030000000000000e-14 |
-1.703286226398000e-15 |
PASS |
| Stress (21) |
2.041423591000000e-18 |
9.677329061999999e-16 |
1.060000000000000e-15 |
-9.656914826089999e-16 |
PASS |
| Stress (22) |
-5.662478911000000e-04 |
-5.662478852000001e-04 |
9.570000000000001e-12 |
-5.899999889688590e-12 |
PASS |
| Stress (23) |
8.016418581000000e-19 |
1.173998455000000e-15 |
1.270000000000000e-14 |
-1.173196813141900e-15 |
PASS |
| Stress (31) |
-1.100938398000000e-18 |
1.702185288000000e-15 |
1.030000000000000e-14 |
-1.703286226398000e-15 |
PASS |
| Stress (32) |
8.016418581000000e-19 |
1.173998455000000e-15 |
1.270000000000000e-14 |
-1.173196813141900e-15 |
PASS |
| Stress (33) |
-5.662478906000000e-04 |
-5.662478851000000e-04 |
9.680000000000001e-12 |
-5.499999978023085e-12 |
PASS |