Wednesday, September 25 2024 07:26:29
UNRES
0.99s| Exit Value | 1 |
|---|
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CTEST_FULL_OUTPUT OpenUnits: processor 1 OpenUnits: processor 0 ns= 0 ns= 0 Calling cxread Calling cxread T of max Cv(T) 281.0 average rms for T<280 9.73124 ERROR: energy differs remarkably from the value read in first 10 warnings wham.out_GB000:Warning: energy differs remarkably from the value read in: 0.98036E+02 0.97710E+02 point 54 54 T 280.0 wham.out_GB000:Warning: energy differs remarkably from the value read in: 0.97855E+02 0.98041E+02 point 62 62 T 280.0 wham.out_GB000:Warning: energy differs remarkably from the value read in: 0.10214E+03 0.10132E+03 point 70 70 T 290.0 wham.out_GB000:Warning: energy differs remarkably from the value read in: 0.11424E+03 0.11404E+03 point 86 86 T 280.0 wham.out_GB000:Warning: energy differs remarkably from the value read in: 0.12988E+03 0.12051E+03 point 166 166 T 300.0 wham.out_GB000:Warning: energy differs remarkably from the value read in: 0.11194E+03 0.11102E+03 point 182 182 T 280.0 wham.out_GB000:Warning: energy differs remarkably from the value read in: 0.94244E+02 0.94102E+02 point 190 190 T 270.0 wham.out_GB000:Warning: energy differs remarkably from the value read in: 0.10153E+03 0.10123E+03 point 214 214 T 270.0 wham.out_GB000:Warning: energy differs remarkably from the value read in: 0.10345E+03 0.95010E+02 point 230 230 T 270.0 wham.out_GB000:Warning: energy differs remarkably from the value read in: 0.11634E+03 0.95117E+02 point 238 238 T 270.0 ERROR wrong average rms for T<280 by more than 4.0
