Input 30-stress.01-independent.inp

Commits > Commit c461bdde143a1ab201b7896fffa943f7e4c29d0f > Run intel-serial: [intel2023a-serial]

Matches

Name Value Reference Precision Difference Status
Stress (11) -4.769687688000000e-03 -4.769687688000000e-03 2.380000000000000e-11 0.000000000000000e+00 PASS
Stress (12) 6.778609408000000e-14 9.312622314999999e-15 1.060000000000000e-13 5.847347176500001e-14 PASS
Stress (13) -3.426237749000000e-14 1.091940018000000e-14 1.060000000000000e-13 -4.518177766999999e-14 PASS
Stress (21) 6.778609408000000e-14 9.312622324999999e-15 1.060000000000000e-13 5.847347175500001e-14 PASS
Stress (22) -4.769687688000000e-03 -4.769687688000000e-03 2.380000000000000e-11 0.000000000000000e+00 PASS
Stress (23) -1.365220655000000e-14 1.536795500000000e-15 1.280000000000000e-13 -1.518900205000000e-14 PASS
Stress (31) -3.426237749000000e-14 1.091940018000000e-14 1.060000000000000e-13 -4.518177766999999e-14 PASS
Stress (32) -1.365220655000000e-14 1.536795500000000e-15 1.280000000000000e-13 -1.518900205000000e-14 PASS
Stress (33) -4.769687688000000e-03 -4.769687687000000e-03 2.380000000000000e-11 -9.999995623233282e-13 PASS
Kinetic stress (11) 1.050163768000000e-02 1.050163768000000e-02 5.250000000000000e-11 -1.734723475976807e-18 PASS
Kinetic stress (12) -7.381267819000000e-14 6.450867639999999e-15 1.090000000000000e-13 -8.026354583000000e-14 PASS
Kinetic stress (13) 5.742051279000000e-14 3.159417150000000e-15 1.250000000000000e-13 5.426109564000000e-14 PASS
Kinetic stress (21) -7.381267819000000e-14 6.450867639999999e-15 1.090000000000000e-13 -8.026354583000000e-14 PASS
Kinetic stress (22) 1.050163768000000e-02 1.050163768000000e-02 5.250000000000000e-11 -1.734723475976807e-18 PASS
Kinetic stress (23) 2.389022313000000e-14 3.094424110000000e-14 1.470000000000000e-13 -7.054017969999997e-15 PASS
Kinetic stress (31) 5.742051279000000e-14 3.159417150000000e-15 1.250000000000000e-13 5.426109564000000e-14 PASS
Kinetic stress (32) 2.389022313000000e-14 3.094424110000000e-14 1.470000000000000e-13 -7.054017969999997e-15 PASS
Kinetic stress (33) 1.050163768000000e-02 1.050163768000000e-02 5.250000000000000e-11 -1.734723475976807e-18 PASS
Hartree stress (11) 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-10 0.000000000000000e+00 PASS
Hartree stress (12) 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-10 0.000000000000000e+00 PASS
Hartree stress (13) 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-10 0.000000000000000e+00 PASS
Hartree stress (21) 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-10 0.000000000000000e+00 PASS
Hartree stress (22) 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-10 0.000000000000000e+00 PASS
Hartree stress (23) 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-10 0.000000000000000e+00 PASS
Hartree stress (31) 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-10 0.000000000000000e+00 PASS
Hartree stress (32) 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-10 0.000000000000000e+00 PASS
Hartree stress (33) 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-10 0.000000000000000e+00 PASS
XC stress (11) 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-10 0.000000000000000e+00 PASS
XC stress (12) 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-10 0.000000000000000e+00 PASS
XC stress (13) 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-10 0.000000000000000e+00 PASS
XC stress (21) 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-10 0.000000000000000e+00 PASS
XC stress (22) 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-10 0.000000000000000e+00 PASS
XC stress (23) 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-10 0.000000000000000e+00 PASS
XC stress (31) 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-10 0.000000000000000e+00 PASS
XC stress (32) 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-10 0.000000000000000e+00 PASS
XC stress (33) 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-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 -4.262944281000001e-19 1.360000000000000e-19 -2.606239969999995e-20 PASS
Ion-ion stress (13) 8.918692209000000e-20 1.081820885000000e-19 5.330000000000000e-20 -1.899516641000001e-20 PASS
Ion-ion stress (21) -4.523568807000000e-19 -4.263020714000000e-19 1.360000000000000e-19 -2.605480930000005e-20 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 3.016593705000000e-20 1.770000000000000e-19 5.946871663000000e-20 PASS
Ion-ion stress (31) 8.918689560000000e-20 1.081804141000000e-19 5.330000000000000e-20 -1.899351850000001e-20 PASS
Ion-ion stress (32) 8.963464045000000e-20 3.015916080000000e-20 1.770000000000000e-19 5.947547965000001e-20 PASS
Ion-ion stress (33) -1.149183583000000e-02 -1.149183583000000e-02 5.750000000000000e-11 0.000000000000000e+00 PASS
Pseudopotential stress (11) 7.465789711000000e-03 7.465789711000000e-03 7.470000000000000e-17 0.000000000000000e+00 PASS
Pseudopotential stress (12) 6.027567334000000e-15 -5.808312165000000e-15 3.690000000000000e-14 1.183587949900000e-14 PASS
Pseudopotential stress (13) -2.315830860000000e-14 -5.812780799999994e-16 3.470000000000000e-14 -2.257703052000000e-14 PASS
Pseudopotential stress (21) 6.027567334000000e-15 -5.808312165000000e-15 3.690000000000000e-14 1.183587949900000e-14 PASS
Pseudopotential stress (22) 7.465789711000000e-03 7.465789711000000e-03 7.470000000000000e-17 0.000000000000000e+00 PASS
Pseudopotential stress (23) -1.023806040000000e-14 -1.600006932000000e-14 3.760000000000000e-14 5.762008919999999e-15 PASS
Pseudopotential stress (31) -2.315830860000000e-14 -5.812780799999994e-16 3.470000000000000e-14 -2.257703052000000e-14 PASS
Pseudopotential stress (32) -1.023806040000000e-14 -1.600006932000000e-14 3.760000000000000e-14 5.762008919999999e-15 PASS
Pseudopotential stress (33) 7.465789711000000e-03 7.465789711000000e-03 7.470000000000000e-17 0.000000000000000e+00 PASS
Pressure (H/b^3) 4.769687690000000e-03 4.769687690000001e-03 4.770000000000000e-17 -8.673617379884035e-19 PASS
Pressure (GPa) 1.403291077900000e+02 1.403291077950000e+02 5.500000000000000e-09 -5.000003966415534e-09 PASS
Compare to other inputs