Input 30-stress.02-gamma_point.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Pressure (H/b^3) |
5.662478890000000e-04 |
5.662478850000000e-04 |
2.830000000000000e-11 |
3.999999984016789e-12 |
PASS |
| Pressure (GPa) |
1.665959414000000e+01 |
1.665959420000000e+01 |
8.330000000000000e-07 |
-6.000000141170858e-08 |
PASS |
| Kinetic stress (11) |
9.361438596000001e-03 |
9.361438596000001e-03 |
4.680000000000000e-11 |
0.000000000000000e+00 |
PASS |
| Kinetic stress (12) |
8.939246912000000e-20 |
-1.577266095000000e-15 |
1.740000000000000e-15 |
1.577355487469120e-15 |
PASS |
| Kinetic stress (13) |
-6.980820002000000e-16 |
-8.541147970000002e-16 |
5.350000000000000e-15 |
1.560327968000001e-16 |
PASS |
| Kinetic stress (21) |
8.939246912000000e-20 |
-1.577266095000000e-15 |
1.740000000000000e-15 |
1.577355487469120e-15 |
PASS |
| Kinetic stress (22) |
9.361438596000001e-03 |
9.361438596000001e-03 |
4.680000000000000e-11 |
0.000000000000000e+00 |
PASS |
| Kinetic stress (23) |
-6.442855364000000e-15 |
-4.920391895000000e-16 |
6.550000000000000e-15 |
-5.950816174499999e-15 |
PASS |
| Kinetic stress (31) |
-6.980820002000000e-16 |
-8.541147970000002e-16 |
5.350000000000000e-15 |
1.560327968000001e-16 |
PASS |
| Kinetic stress (32) |
-6.442855364000000e-15 |
-4.920391895000000e-16 |
6.550000000000000e-15 |
-5.950816174499999e-15 |
PASS |
| Kinetic stress (33) |
9.361438596000001e-03 |
9.361438596000001e-03 |
4.680000000000000e-11 |
0.000000000000000e+00 |
PASS |
| Hartree stress (11) |
8.859962925000000e-04 |
8.859962924000001e-04 |
4.430000000000000e-12 |
9.999997791637627e-14 |
PASS |
| Hartree stress (12) |
2.457199363000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
2.457199363000000e-20 |
PASS |
| Hartree stress (13) |
-6.626155586000000e-21 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-6.626155586000000e-21 |
PASS |
| Hartree stress (21) |
2.457199363000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
2.457199363000000e-20 |
PASS |
| Hartree stress (22) |
8.859962925000000e-04 |
8.859962924000001e-04 |
4.430000000000000e-12 |
9.999997791637627e-14 |
PASS |
| Hartree stress (23) |
-1.325231117000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-1.325231117000000e-20 |
PASS |
| Hartree stress (31) |
-6.626155586000000e-21 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-6.626155586000000e-21 |
PASS |
| Hartree stress (32) |
-1.325231117000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-1.325231117000000e-20 |
PASS |
| Hartree stress (33) |
8.859962925000000e-04 |
8.859962924000001e-04 |
4.430000000000000e-12 |
9.999997791637627e-14 |
PASS |
| XC stress (11) |
-3.734425480000000e-03 |
-3.734425480000000e-03 |
1.870000000000000e-10 |
0.000000000000000e+00 |
PASS |
| XC stress (12) |
2.898589097000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
2.898589097000000e-20 |
PASS |
| XC stress (13) |
2.508276315000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
2.508276315000000e-20 |
PASS |
| XC stress (21) |
2.898589097000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
2.898589097000000e-20 |
PASS |
| XC stress (22) |
-3.734425480000000e-03 |
-3.734425480000000e-03 |
1.870000000000000e-10 |
0.000000000000000e+00 |
PASS |
| XC stress (23) |
6.951472343000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
6.951472343000000e-20 |
PASS |
| XC stress (31) |
2.508276315000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
2.508276315000000e-20 |
PASS |
| XC stress (32) |
6.951472343000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
6.951472343000000e-20 |
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) |
-4.559343973000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-4.559343973000000e-19 |
PASS |
| Ion-ion stress (13) |
5.974689174000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
5.974689174000000e-20 |
PASS |
| Ion-ion stress (21) |
-4.559479503000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-4.559479503000000e-19 |
PASS |
| Ion-ion stress (22) |
-1.149183583000000e-02 |
-1.149183583000000e-02 |
5.750000000000000e-11 |
0.000000000000000e+00 |
PASS |
| Ion-ion stress (23) |
-1.303989486000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-1.303989486000000e-19 |
PASS |
| Ion-ion stress (31) |
5.974520406000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
5.974520406000000e-20 |
PASS |
| Ion-ion stress (32) |
-1.303989023000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-1.303989023000000e-19 |
PASS |
| Ion-ion stress (33) |
-1.149183583000000e-02 |
-1.149183583000000e-02 |
5.750000000000000e-11 |
0.000000000000000e+00 |
PASS |
| Stress (11) |
-5.662478891000000e-04 |
-5.662478856000000e-04 |
8.850000000000000e-12 |
-3.499999986014690e-12 |
PASS |
| Stress (12) |
-7.198594530000000e-19 |
9.677328992000001e-16 |
1.060000000000000e-15 |
-9.684527586530002e-16 |
PASS |
| Stress (13) |
1.386425543000000e-15 |
1.702185288000000e-15 |
1.030000000000000e-14 |
-3.157597450000001e-16 |
PASS |
| Stress (21) |
-7.198459000000000e-19 |
9.677329061999999e-16 |
1.060000000000000e-15 |
-9.684527520999999e-16 |
PASS |
| Stress (22) |
-5.662478890000000e-04 |
-5.662478852000001e-04 |
8.640000000000000e-12 |
-3.799999919763819e-12 |
PASS |
| Stress (23) |
1.269111307000000e-14 |
1.173998455000000e-15 |
1.270000000000000e-14 |
1.151711461500000e-14 |
PASS |
| Stress (31) |
1.386425545000000e-15 |
1.702185288000000e-15 |
1.030000000000000e-14 |
-3.157597430000000e-16 |
PASS |
| Stress (32) |
1.269111307000000e-14 |
1.173998455000000e-15 |
1.270000000000000e-14 |
1.151711461500000e-14 |
PASS |
| Stress (33) |
-5.662478888000000e-04 |
-5.662478851000000e-04 |
8.800000000000000e-12 |
-3.700000050267660e-12 |
PASS |