Friday, September 20 2024 17:20:28
UNRES
2.80s| Exit Value | 1 |
|---|---|
| Processors | [Graph]1 |
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CTEST_FULL_OUTPUT OpenUnits: processor 0 ns= 0 OpenUnits: processor 1 ns= 0 Calling cxread Calling cxread Note: The following floating-point exceptions are signalling: IEEE_INVALID_FLAG IEEE_DIVIDE_BY_ZERO IEEE_UNDERFLOW_FLAG IEEE_DENORMAL Note: The following floating-point exceptions are signalling: IEEE_INVALID_FLAG IEEE_DIVIDE_BY_ZERO IEEE_OVERFLOW_FLAG IEEE_UNDERFLOW_FLAG IEEE_DENORMAL T of max Cv(T) 275.0 average rms for T<280 9.2994 ERROR: energy differs remarkably from the value read in first 10 warnings wham.out_GB000:Warning: energy differs remarkably from the value read in: -0.33751E+02 Infinity point 213 213 T 330.0 wham.out_GB000:Warning: energy differs remarkably from the value read in: -0.91587E+02 Infinity point 497 497 T 270.0 wham.out_GB000:Warning: energy differs remarkably from the value read in: -0.57166E+02 Infinity point 513 513 T 330.0 wham.out_GB000:Warning: energy differs remarkably from the value read in: -0.44569E+02 Infinity point 517 517 T 345.0 wham.out_GB000:Warning: energy differs remarkably from the value read in: -0.51822E+02 Infinity point 521 521 T 345.0 wham.out_GB000:Warning: energy differs remarkably from the value read in: -0.56993E+02 Infinity point 525 525 T 330.0 wham.out_GB000:Warning: energy differs remarkably from the value read in: -0.33299E+02 Infinity point 533 533 T 345.0 wham.out_GB000:Warning: energy differs remarkably from the value read in: -0.63074E+02 Infinity point 561 561 T 300.0 wham.out_GB000:Warning: energy differs remarkably from the value read in: -0.41935E+02 Infinity point 593 593 T 310.0 wham.out_GB000:Warning: energy differs remarkably from the value read in: -0.41656E+02 Infinity point 597 597 T 330.0
