Wednesday, September 11 2024 23:38:06
UNRES
4.70s| Exit Value | 1 |
|---|
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CTEST_FULL_OUTPUT OpenUnits: processor 0 OpenUnits: processor 1 ns= 0 ns= 0 ishiftca= 1 ilastca= 76 ishiftca= 1 ilastca= 76 Calling cxread Calling cxread T of max Cv(T) 600.0 average rms for T<260 0 ERROR: energy differs remarkably from the value read in first 10 warnings dfa_wham.out_GB000:Warning: energy differs remarkably from the value read in: -0.40708E+03 -0.40679E+03 point 1 1 T 280.0 dfa_wham.out_GB000:Warning: energy differs remarkably from the value read in: -0.57833E+03 -0.57785E+03 point 2 2 T 240.0 dfa_wham.out_GB000:Warning: energy differs remarkably from the value read in: -0.51181E+03 -0.51156E+03 point 3 3 T 260.0 dfa_wham.out_GB000:Warning: energy differs remarkably from the value read in: -0.41714E+03 -0.41691E+03 point 4 4 T 300.0 dfa_wham.out_GB000:Warning: energy differs remarkably from the value read in: -0.38667E+03 -0.38642E+03 point 5 5 T 360.0 dfa_wham.out_GB000:Warning: energy differs remarkably from the value read in: -0.51371E+03 -0.51335E+03 point 6 6 T 320.0 dfa_wham.out_GB000:Warning: energy differs remarkably from the value read in: -0.42268E+03 -0.42242E+03 point 7 7 T 340.0 dfa_wham.out_GB000:Warning: energy differs remarkably from the value read in: -0.33738E+03 -0.33698E+03 point 8 8 T 390.0 dfa_wham.out_GB000:Warning: energy differs remarkably from the value read in: -0.36693E+03 -0.36656E+03 point 9 9 T 340.0 dfa_wham.out_GB000:Warning: energy differs remarkably from the value read in: -0.56639E+03 -0.56591E+03 point 10 10 T 240.0 ERROR wrong T max of Cv(T) by more than 10 K
