Input 30-stress.02-gamma_point.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Pressure (H/b^3) |
5.654916930000000e-04 |
5.654916880000001e-04 |
2.830000000000000e-11 |
4.999999980020986e-12 |
PASS |
| Pressure (GPa) |
1.663734607000000e+01 |
1.663734593000000e+01 |
1.540000000000000e-07 |
1.400000009255109e-07 |
PASS |
| Kinetic stress (11) |
9.361514559000000e-03 |
9.361514553000000e-03 |
4.680000000000000e-11 |
6.000000843386921e-12 |
PASS |
| Kinetic stress (12) |
5.551115123000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
5.551115123000000e-19 |
PASS |
| Kinetic stress (13) |
-1.942890293000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-1.942890293000000e-19 |
PASS |
| Kinetic stress (21) |
5.551115123000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
5.551115123000000e-19 |
PASS |
| Kinetic stress (22) |
9.361514559000000e-03 |
9.361514554000000e-03 |
4.680000000000000e-11 |
5.000000413701855e-12 |
PASS |
| Kinetic stress (23) |
-6.661338148000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-6.661338148000000e-19 |
PASS |
| Kinetic stress (31) |
-1.942890293000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-1.942890293000000e-19 |
PASS |
| Kinetic stress (32) |
-6.661338148000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-6.661338148000000e-19 |
PASS |
| Kinetic stress (33) |
9.361514559000000e-03 |
9.361514553000000e-03 |
4.680000000000000e-11 |
6.000000843386921e-12 |
PASS |
| Hartree stress (11) |
8.860627375000000e-04 |
8.860627345999999e-04 |
4.430000000000000e-12 |
2.900000118516433e-12 |
PASS |
| Hartree stress (12) |
-3.939801676000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-3.939801676000000e-19 |
PASS |
| Hartree stress (13) |
1.159577228000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.159577228000000e-20 |
PASS |
| Hartree stress (21) |
-3.939801676000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-3.939801676000000e-19 |
PASS |
| Hartree stress (22) |
8.860627375000000e-04 |
8.860627345999999e-04 |
4.430000000000000e-12 |
2.900000118516433e-12 |
PASS |
| Hartree stress (23) |
1.380449080000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.380449080000000e-20 |
PASS |
| Hartree stress (31) |
1.159577228000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.159577228000000e-20 |
PASS |
| Hartree stress (32) |
1.380449080000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.380449080000000e-20 |
PASS |
| Hartree stress (33) |
8.860627375000000e-04 |
8.860627345999999e-04 |
4.430000000000000e-12 |
2.900000118516433e-12 |
PASS |
| XC stress (11) |
-3.734288399000000e-03 |
-3.734288397500000e-03 |
1.650000000000000e-12 |
-1.499999343484992e-12 |
PASS |
| XC stress (12) |
2.033514348000000e-21 |
0.000000000000000e+00 |
1.000000000000000e-15 |
2.033514348000000e-21 |
PASS |
| XC stress (13) |
5.407521863000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
5.407521863000000e-20 |
PASS |
| XC stress (21) |
2.033514348000000e-21 |
0.000000000000000e+00 |
1.000000000000000e-15 |
2.033514348000000e-21 |
PASS |
| XC stress (22) |
-3.734288399000000e-03 |
-3.734288397500000e-03 |
1.650000000000000e-12 |
-1.499999343484992e-12 |
PASS |
| XC stress (23) |
1.928588142000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.928588142000000e-20 |
PASS |
| XC stress (31) |
5.407521863000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
5.407521863000000e-20 |
PASS |
| XC stress (32) |
1.928588142000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.928588142000000e-20 |
PASS |
| XC stress (33) |
-3.734288399000000e-03 |
-3.734288397500000e-03 |
1.650000000000000e-12 |
-1.499999343484992e-12 |
PASS |
| Ion-ion stress (11) |
-1.149183583000000e-02 |
-1.149183583000000e-02 |
5.750000000000000e-11 |
0.000000000000000e+00 |
PASS |
| Ion-ion stress (12) |
-4.451112881000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-4.451112881000000e-19 |
PASS |
| Ion-ion stress (13) |
6.623349638000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
6.623349638000000e-20 |
PASS |
| Ion-ion stress (21) |
-4.451248145000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-4.451248145000000e-19 |
PASS |
| Ion-ion stress (22) |
-1.149183583000000e-02 |
-1.149183583000000e-02 |
5.750000000000000e-11 |
0.000000000000000e+00 |
PASS |
| Ion-ion stress (23) |
-1.229906970000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-1.229906970000000e-19 |
PASS |
| Ion-ion stress (31) |
6.623180208000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
6.623180208000000e-20 |
PASS |
| Ion-ion stress (32) |
-1.229906706000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-1.229906706000000e-19 |
PASS |
| Ion-ion stress (33) |
-1.149183583000000e-02 |
-1.149183583000000e-02 |
5.750000000000000e-11 |
0.000000000000000e+00 |
PASS |
| Stress (11) |
-5.654916929000000e-04 |
-5.654916880999999e-04 |
5.280000000000000e-12 |
-4.800000024188233e-12 |
PASS |
| Stress (12) |
-1.423710743000000e-18 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-1.423710743000000e-18 |
PASS |
| Stress (13) |
-2.632184638000000e-21 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-2.632184638000000e-21 |
PASS |
| Stress (21) |
-1.423697217000000e-18 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-1.423697217000000e-18 |
PASS |
| Stress (22) |
-5.654916927000000e-04 |
-5.654916881999999e-04 |
4.950000000000000e-12 |
-4.500000090439105e-12 |
PASS |
| Stress (23) |
1.006850245000000e-18 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.006850245000000e-18 |
PASS |
| Stress (31) |
-2.630490341000000e-21 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-2.630490341000000e-21 |
PASS |
| Stress (32) |
1.006850218000000e-18 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.006850218000000e-18 |
PASS |
| Stress (33) |
-5.654916926000000e-04 |
-5.654916880000001e-04 |
5.060000000000000e-12 |
-4.599999959935264e-12 |
PASS |