Input 30-stress.02-gamma_point.inp

Commits > Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 > Run intel-2022a_omp

Matches

Name Value Reference Precision Difference Status
Pressure (H/b^3) 5.654916870000000e-04 5.654916880000001e-04 2.830000000000000e-11 -1.000000104424414e-12 PASS
Pressure (GPa) 1.663734589000000e+01 1.663734593000000e+01 1.540000000000000e-07 -3.999999975690116e-08 PASS
Kinetic stress (11) 9.361514555000000e-03 9.361514553000000e-03 4.680000000000000e-11 2.000000859370132e-12 PASS
Kinetic stress (12) 1.776356839000000e-18 0.000000000000000e+00 1.000000000000000e-15 1.776356839000000e-18 PASS
Kinetic stress (13) 1.942890293000000e-19 0.000000000000000e+00 1.000000000000000e-15 1.942890293000000e-19 PASS
Kinetic stress (21) 1.776356839000000e-18 0.000000000000000e+00 1.000000000000000e-15 1.776356839000000e-18 PASS
Kinetic stress (22) 9.361514555000000e-03 9.361514554000000e-03 4.680000000000000e-11 1.000000429685066e-12 PASS
Kinetic stress (23) -1.110223025000000e-19 0.000000000000000e+00 1.000000000000000e-15 -1.110223025000000e-19 PASS
Kinetic stress (31) 1.942890293000000e-19 0.000000000000000e+00 1.000000000000000e-15 1.942890293000000e-19 PASS
Kinetic stress (32) -1.110223025000000e-19 0.000000000000000e+00 1.000000000000000e-15 -1.110223025000000e-19 PASS
Kinetic stress (33) 9.361514555000000e-03 9.361514553000000e-03 4.680000000000000e-11 2.000000859370132e-12 PASS
Hartree stress (11) 8.860627358000000e-04 8.860627345999999e-04 4.430000000000000e-12 1.200000060257167e-12 PASS
Hartree stress (12) 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-15 0.000000000000000e+00 PASS
Hartree stress (13) -1.656538897000000e-20 0.000000000000000e+00 1.000000000000000e-15 -1.656538897000000e-20 PASS
Hartree stress (21) 0.000000000000000e+00 0.000000000000000e+00 1.000000000000000e-15 0.000000000000000e+00 PASS
Hartree stress (22) 8.860627358000000e-04 8.860627345999999e-04 4.430000000000000e-12 1.200000060257167e-12 PASS
Hartree stress (23) -1.021532320000000e-20 0.000000000000000e+00 1.000000000000000e-15 -1.021532320000000e-20 PASS
Hartree stress (31) -1.656538897000000e-20 0.000000000000000e+00 1.000000000000000e-15 -1.656538897000000e-20 PASS
Hartree stress (32) -1.021532320000000e-20 0.000000000000000e+00 1.000000000000000e-15 -1.021532320000000e-20 PASS
Hartree stress (33) 8.860627358000000e-04 8.860627345999999e-04 4.430000000000000e-12 1.200000060257167e-12 PASS
XC stress (11) -3.734288398000000e-03 -3.734288397500000e-03 1.650000000000000e-12 -4.999993474807951e-13 PASS
XC stress (12) -3.883264898000000e-20 0.000000000000000e+00 1.000000000000000e-15 -3.883264898000000e-20 PASS
XC stress (13) -5.617988373999999e-20 0.000000000000000e+00 1.000000000000000e-15 -5.617988373999999e-20 PASS
XC stress (21) -3.883264898000000e-20 0.000000000000000e+00 1.000000000000000e-15 -3.883264898000000e-20 PASS
XC stress (22) -3.734288398000000e-03 -3.734288397500000e-03 1.650000000000000e-12 -4.999993474807951e-13 PASS
XC stress (23) 2.017505425000000e-20 0.000000000000000e+00 1.000000000000000e-15 2.017505425000000e-20 PASS
XC stress (31) -5.617988373999999e-20 0.000000000000000e+00 1.000000000000000e-15 -5.617988373999999e-20 PASS
XC stress (32) 2.017505425000000e-20 0.000000000000000e+00 1.000000000000000e-15 2.017505425000000e-20 PASS
XC stress (33) -3.734288398000000e-03 -3.734288397500000e-03 1.650000000000000e-12 -4.999993474807951e-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) -5.654916867000000e-04 -5.654916880999999e-04 5.280000000000000e-12 1.399999907669702e-12 PASS
Stress (12) -1.722346123000000e-18 0.000000000000000e+00 1.000000000000000e-15 -1.722346123000000e-18 PASS
Stress (13) -3.889298933000000e-19 0.000000000000000e+00 1.000000000000000e-15 -3.889298933000000e-19 PASS
Stress (21) -1.722346070000000e-18 0.000000000000000e+00 1.000000000000000e-15 -1.722346070000000e-18 PASS
Stress (22) -5.654916868000000e-04 -5.654916881999999e-04 4.950000000000000e-12 1.399999907669702e-12 PASS
Stress (23) -1.447637559000000e-20 0.000000000000000e+00 1.000000000000000e-15 -1.447637559000000e-20 PASS
Stress (31) -3.889298668000000e-19 0.000000000000000e+00 1.000000000000000e-15 -3.889298668000000e-19 PASS
Stress (32) -1.447636235000000e-20 0.000000000000000e+00 1.000000000000000e-15 -1.447636235000000e-20 PASS
Stress (33) -5.654916867000000e-04 -5.654916880000001e-04 5.060000000000000e-12 1.300000038173543e-12 PASS
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