Input 30-stress.02-gamma_point.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| Pressure (H/b^3) |
5.654916900000000e-04 |
5.654916880000001e-04 |
2.830000000000000e-11 |
1.999999883588177e-12 |
PASS |
| Pressure (GPa) |
1.663734597000000e+01 |
1.663734593000000e+01 |
1.540000000000000e-07 |
3.999999975690116e-08 |
PASS |
| Kinetic stress (11) |
9.361514553000000e-03 |
9.361514553000000e-03 |
4.680000000000000e-11 |
0.000000000000000e+00 |
PASS |
| Kinetic stress (12) |
-5.152128724000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-5.152128724000000e-19 |
PASS |
| Kinetic stress (13) |
-1.367829461000000e-18 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-1.367829461000000e-18 |
PASS |
| Kinetic stress (21) |
-5.152128724000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-5.152128724000000e-19 |
PASS |
| Kinetic stress (22) |
9.361514553000000e-03 |
9.361514554000000e-03 |
4.680000000000000e-11 |
-1.000000429685066e-12 |
PASS |
| Kinetic stress (23) |
1.110223025000000e-18 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.110223025000000e-18 |
PASS |
| Kinetic stress (31) |
-1.367829461000000e-18 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-1.367829461000000e-18 |
PASS |
| Kinetic stress (32) |
1.110223025000000e-18 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.110223025000000e-18 |
PASS |
| Kinetic stress (33) |
9.361514553000000e-03 |
9.361514553000000e-03 |
4.680000000000000e-11 |
0.000000000000000e+00 |
PASS |
| Hartree stress (11) |
8.860627342000000e-04 |
8.860627345999999e-04 |
4.430000000000000e-12 |
-3.999999116655051e-13 |
PASS |
| Hartree stress (12) |
-8.337912445999999e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-8.337912445999999e-20 |
PASS |
| Hartree stress (13) |
-3.865257425000000e-21 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-3.865257425000000e-21 |
PASS |
| Hartree stress (21) |
-8.337912445999999e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-8.337912445999999e-20 |
PASS |
| Hartree stress (22) |
8.860627342000000e-04 |
8.860627345999999e-04 |
4.430000000000000e-12 |
-3.999999116655051e-13 |
PASS |
| Hartree stress (23) |
1.849801768000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.849801768000000e-20 |
PASS |
| Hartree stress (31) |
-3.865257425000000e-21 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-3.865257425000000e-21 |
PASS |
| Hartree stress (32) |
1.849801768000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.849801768000000e-20 |
PASS |
| Hartree stress (33) |
8.860627342000000e-04 |
8.860627345999999e-04 |
4.430000000000000e-12 |
-3.999999116655051e-13 |
PASS |
| XC stress (11) |
-3.734288397000000e-03 |
-3.734288397500000e-03 |
1.650000000000000e-12 |
5.000006485234021e-13 |
PASS |
| XC stress (12) |
-2.895433899000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-2.895433899000000e-20 |
PASS |
| XC stress (13) |
1.267902443000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.267902443000000e-20 |
PASS |
| XC stress (21) |
-2.895433899000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-2.895433899000000e-20 |
PASS |
| XC stress (22) |
-3.734288397000000e-03 |
-3.734288397500000e-03 |
1.650000000000000e-12 |
5.000006485234021e-13 |
PASS |
| XC stress (23) |
8.836882979999999e-21 |
0.000000000000000e+00 |
1.000000000000000e-15 |
8.836882979999999e-21 |
PASS |
| XC stress (31) |
1.267902443000000e-20 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.267902443000000e-20 |
PASS |
| XC stress (32) |
8.836882979999999e-21 |
0.000000000000000e+00 |
1.000000000000000e-15 |
8.836882979999999e-21 |
PASS |
| XC stress (33) |
-3.734288397000000e-03 |
-3.734288397500000e-03 |
1.650000000000000e-12 |
5.000006485234021e-13 |
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) |
-5.654916895000000e-04 |
-5.654916880999999e-04 |
5.280000000000000e-12 |
-1.400000016089920e-12 |
PASS |
| Stress (12) |
9.546255371000001e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
9.546255371000001e-19 |
PASS |
| Stress (13) |
1.447301920000000e-18 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.447301920000000e-18 |
PASS |
| Stress (21) |
9.546255901000000e-19 |
0.000000000000000e+00 |
1.000000000000000e-15 |
9.546255901000000e-19 |
PASS |
| Stress (22) |
-5.654916897000000e-04 |
-5.654916881999999e-04 |
4.950000000000000e-12 |
-1.500000102426513e-12 |
PASS |
| Stress (23) |
-1.124546047000000e-18 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-1.124546047000000e-18 |
PASS |
| Stress (31) |
1.447301946000000e-18 |
0.000000000000000e+00 |
1.000000000000000e-15 |
1.447301946000000e-18 |
PASS |
| Stress (32) |
-1.124546034000000e-18 |
0.000000000000000e+00 |
1.000000000000000e-15 |
-1.124546034000000e-18 |
PASS |
| Stress (33) |
-5.654916894000000e-04 |
-5.654916880000001e-04 |
5.060000000000000e-12 |
-1.399999907669702e-12 |
PASS |